KEMENTRIAN RISET, TEKNOLOGI DAN PENDIDIKAN TINGGI

UNIVERSITAS BRAWIJAYA
LABORATORIUM SENTRAL ILMU HAYATI
Jl Veteran, Malang 65145, Indonesia
Telp/Fax. +62341 559054
http://lsih.ub.ac.id Email : laboratoriumsentral@Ub.ac.id ; laboratoriumsentral@gmail.com

Chromatogram SW Blending02 C:\GCMSsolution\Data\Project1\24112020\SW Blending 02.qgd

TIC
3,500,000 17.454

20.654
19.908

24.276
13.748

20.866

23.551
20.012
15.917

28.824
17.315

25.782
14.028

17.696

27.332
24.999

28.131
28.346

29.576
23.358

28.962
26.649
14.0 15.0 16.0 17.0 18.0 19.0 20.0 21.0 22.0 23.0 24.0 25.0 26.0 27.0 28.0 29.0 30.0
min

Quantitative Result Table

ID# Name R.Time m/z Area Height Conc. Conc.Unit R.Index
1 Cyclohexene, 1-methyl-4-(1-methylethenyl)-, (R)- (CAS)13.749 68.00 191350 64242 2.656 % 0
2 1,3,6-Octatriene, 3,7-dimethyl-, (E)- (CAS) 14.024 93.00 15585 5546 0.216 % 0
3 .ALPHA.-TERPINOLENE 15.920 41.00 41709 13165 0.579 % 0
4 (-)-Isopulegol 17.311 41.00 22673 7103 0.315 % 0
5 CITRONELLA 17.454 41.00 2391806 728266 33.202 % 0
6 (-)-Isopulegol 17.695 41.00 8752 2743 0.121 % 0
7 .beta.-Citronellol 19.907 41.00 722652 228323 10.031 % 0
8 Z-Citral 20.013 41.00 171451 47351 2.380 % 0
9 trans-Geraniol 20.654 69.00 2668826 823833 37.047 % 0
10 Citral 20.866 41.00 322026 86404 4.470 % 0
11 Phenol, 2-methoxy-4-(2-propenyl)- (CAS) 23.343 164.00 8642 2205 0.120 % 0
12 Citronellyl acetate 23.551 41.00 106110 32528 1.473 % 0
13 Geranyl acetate 24.276 69.00 264302 87238 3.669 % 0
14 2,4-DIISOPROPENYL-1-METHYL-1-VINYL-CYCLOHEXANE 24.996 67.00 24133 6754 0.335 % 0
15 trans-Caryophyllene 25.783 41.00 50338 14891 0.699 % 0
16 .alpha.-Humulene (CAS) 26.651 93.00 9043 2484 0.126 % 0
17 GERMACRENE-D 27.333 161.00 26609 7754 0.369 % 0
18 .gamma.-Cadinene (CAS) 28.130 161.00 28589 8616 0.397 % 0
19 .delta.-Cadinene (CAS) 28.344 161.00 23311 7343 0.324 % 0
20 Elemol 28.824 59.00 64313 18253 0.893 % 0
21 Propanoic acid, 2-methyl-, 3,7-dimethyl-2,6-octadienyl ester,
28.960(E)- (CAS) 69.00 15139 5001 0.210 % 0
22 GERMACRENE D-4-OL 29.577 81.00 26475 7034 0.368 % 0

Library
<< Target >>
Line#:1 R.Time:13.750(Scan#:1951) MassPeaks:450
RawMode:Averaged 13.745-13.755(1950-1952) BasePeak:68.00(62313)
BG Mode:Calc. from Peak Group 1 - Event 1 Scan
100 68
80
60
40 41
93
79
53
20 107 136
30 154 172 195 223 245 267 305321 340 372 403 421 443 470 487 505 522 553 585 606 642 671 690 725 749 771 797

10 50 90 130 170 210 250 290 330 370 410 450 490 530 570 610 650 690 730 770
Hit#:1 Entry:33801 Library:Wiley9.lib
SI:95 Formula:C10H16 CAS:5989-27-5 MolWeight:136 RetIndex:0
CompName:Cyclohexene, 1-methyl-4-(1-methylethenyl)-, (R)- (CAS) $$ D-1,8(9)-P-MENTHADIENE,(D-1-METHYL-4-ISOPROPENYLCYCLOHEXENE $$ d-Limonene $$ (+)-Limonene $$ d-(+)-
100 68
80
60
93
40
27 39 53
20 79
121
55 69
15 26 103

10 50 90 130 170 210 250 290 330 370 410 450 490 530 570 610 650 690 730 770
<< Target >>
Line#:1 R.Time:13.750(Scan#:1951) MassPeaks:450
RawMode:Averaged 13.745-13.755(1950-1952) BasePeak:68.00(62313)
BG Mode:Calc. from Peak Group 1 - Event 1 Scan
100 68
80
60
40 41
93
79
53
20 107 136
30 154 172 195 223 245 267 305321 340 372 403 421 443 470 487 505 522 553 585 606 642 671 690 725 749 771 797

10 50 90 130 170 210 250 290 330 370 410 450 490 530 570 610 650 690 730 770
Hit#:2 Entry:33794 Library:Wiley9.lib
SI:94 Formula:C10H16 CAS:138-86-3 MolWeight:136 RetIndex:0
CompName:dl-Limonene $$ Cyclohexene, 1-methyl-4-(1-methylethenyl)- (CAS) $$ 1-P-MENTHA-1,8-DIENE $$ Limonene $Cinen $$ Nesol $$ Cinene $$ Limonen $$ Eulimen $$ Dipenten $$ Cajepu
100 68
80
60
93
40 39
27 53
20 77 107121
42 5565 119

10 50 90 130 170 210 250 290 330 370 410 450 490 530 570 610 650 690 730 770
Hit#:3 Entry:33923 Library:Wiley9.lib
SI:93 Formula:C10H16 CAS:464-17-5 MolWeight:136 RetIndex:0
CompName:BICYCLO[2.2.1]HEPT-2-ENE, 1,7,7-TRIMETHYL- $$ 1,7, 7-TRIMETHYL-2-NORBORNENE $$ 1,7,7-TRIMETHYL-2-NORBORNENE $$ 1,7,7-TRIMETHYL-BICYCLO[2.2.1]HEP
100 68
80
60
93
40
41 53 79
20 27 77 107121
42 5565 89 108

10 50 90 130 170 210 250 290 330 370 410 450 490 530 570 610 650 690 730 770
Hit#:4 Entry:33835 Library:Wiley9.lib
SI:93 Formula:C10H16 CAS:5989-54-8 MolWeight:136 RetIndex:0
CompName:l-Limonene $$ Cyclohexene, 1-methyl-4-(1-methylethenyl)-, (S)- (CAS) $$ $ (-)-Limonene $$ p-Mentha-1,8-diene, (S)-(-)- (CAS) $$ (-)-Limonene $$ Limonene $$ 4-Isopropenyl-1-methyl-
100 68
80
60
93
40 39
27 53 79
20 107 136
15 26 55 69
103

10 50 90 130 170 210 250 290 330 370 410 450 490 530 570 610 650 690 730 770
Hit#:5 Entry:33796 Library:Wiley9.lib
SI:92 Formula:C10H16 CAS:0-00-0 MolWeight:136 RetIndex:0
CompName:(+)-LIMONEN $$ 4-ISOPROPENYL-1-METHYL-1-CYCLOHEXENE
100 68
80
60 93
40
41 53 79
20 27 77 107121
5565
3242 89 108

10 50 90 130 170 210 250 290 330 370 410 450 490 530 570 610 650 690 730 770
<< Target >>
Line#:2 R.Time:14.030(Scan#:2007) MassPeaks:353
RawMode:Averaged 14.025-14.035(2006-2008) BasePeak:93.05(4634)
BG Mode:Calc. from Peak Group 1 - Event 1 Scan
100 93
80 41
60 79

40 43
67
20 105
30 121136 154 175 201 230 262 278 307 325 345 363 383 411 443 465 483 500 520 549 566582 602 620 638653 683 710 733 752 778

20 60 100 140 180 220 260 300 340 380 420 460 500 540 580 620 660 700 740 780
Hit#:1 Entry:33603 Library:Wiley9.lib
SI:92 Formula:C10H16 CAS:3779-61-1 MolWeight:136 RetIndex:0
CompName:1,3,6-Octatriene, 3,7-dimethyl-, (E)- (CAS) $$ .BETA. OCIMENE Y $$ trans-.beta.-Ocimene $$ .beta.-trans-Ocimene $$ Ocimene, trans-.beta.- $$ trans-3,7-Dimethyl-1,3,6-octatriene $$ B
100 93
80
60 41
77
40
43
55
20 65 105 121
136
108 138

20 60 100 140 180 220 260 300 340 380 420 460 500 540 580 620 660 700 740 780
Hit#:2 Entry:33629 Library:Wiley9.lib
SI:92 Formula:C10H16 CAS:502-99-8 MolWeight:136 RetIndex:0
CompName:Trans-Ocimene $$ 1,3,7-Octatriene, 3,7-dimethyl- (CAS) $$ 2,6-Dimethyl-1,5,7-octatriene $$ Ocimene $$ .alpha.-Ocimene (CAS) $$ 3,7-Dimethyl-1,3,7-octatriene $$ (3E)-3,7-Dimethyl-1
100 93
80
41
60 27

40 43 77
55
20 65 105 121
136

20 60 100 140 180 220 260 300 340 380 420 460 500 540 580 620 660 700 740 780
Hit#:3 Entry:33600 Library:Wiley9.lib
SI:91 Formula:C10H16 CAS:3779-61-1 MolWeight:136 RetIndex:0
CompName:1,3,6-Octatriene, 3,7-dimethyl-, (E)- (CAS) $$ .BETA. OCIMENE Y $$ trans-.beta.-Ocimene $$ .beta.-trans-Ocimene $$ Ocimene, trans-.beta.- $$ trans-3,7-Dimethyl-1,3,6-octatriene $$ B
100 93
80
60 41 79
40 39
53
20 65 81
105 121
50 119

20 60 100 140 180 220 260 300 340 380 420 460 500 540 580 620 660 700 740 780
Hit#:4 Entry:33597 Library:Wiley9.lib
SI:90 Formula:C10H16 CAS:3338-55-4 MolWeight:136 RetIndex:0
CompName:1,3,6-Octatriene, 3,7-dimethyl-, (Z)- (CAS) $$ cis-3,7-Dimethyl-1,3,6-octatriene $$ .BETA. OCIMENE X $$ Z-Ocimene $$ .beta.-cis-Ocimene $$ cis-.beta.-Ocimene $$ Ocimene, cis-.beta
100 93
80
60
79
40 39
53
20 65 81
105
50 107

20 60 100 140 180 220 260 300 340 380 420 460 500 540 580 620 660 700 740 780
Hit#:5 Entry:33599 Library:Wiley9.lib
SI:89 Formula:C10H16 CAS:3779-61-1 MolWeight:136 RetIndex:0
CompName:1,3,6-Octatriene, 3,7-dimethyl-, (E)- (CAS) $$ .BETA. OCIMENE Y $$ trans-.beta.-Ocimene $$ .beta.-trans-Ocimene $$ Ocimene, trans-.beta.- $$ trans-3,7-Dimethyl-1,3,6-octatriene $$ B
100 93
80
60
41
40 27 77
20 43 55 105 121
65 89 108 136

20 60 100 140 180 220 260 300 340 380 420 460 500 540 580 620 660 700 740 780
<< Target >>
Line#:3 R.Time:15.915(Scan#:2384) MassPeaks:356
RawMode:Averaged 15.910-15.920(2383-2385) BasePeak:41.00(12046)
BG Mode:Calc. from Peak Group 1 - Event 1 Scan
100 41 71
80
60
69
93
40
20
31 105 121136 153 171 193 223 241 258 280296 320 346 364 381397 418 443 471 502 528 557 587 615 637 661 693 717 738 762 791

20 60 100 140 180 220 260 300 340 380 420 460 500 540 580 620 660 700 740 780
Hit#:1 Entry:33854 Library:Wiley9.lib
SI:96 Formula:C10H16 CAS:586-62-9 MolWeight:136 RetIndex:0
CompName:.ALPHA.-TERPINOLENE $$ Cyclohexene, 1-methyl-4-(1-methylethylidene)- (CAS) $$ 1,4(8)-P-MENTHADIENE $$ 1-METHYLENE-4-ISOPROPYLENECYCLOHEXANE $$ Terpino
100 41 71
80
55
93
60
40 80
53
20 121
65 7785 97 136

20 60 100 140 180 220 260 300 340 380 420 460 500 540 580 620 660 700 740 780
Hit#:2 Entry:57945 Library:Wiley9.lib
SI:94 Formula:C10H18O CAS:78-70-6 MolWeight:154 RetIndex:0
CompName:1,6-OCTADIEN-3-OL, 3,7-DIMETHYL- $$ 3,7-DIMETHYLOCTA-1,6-DIEN-3-OL $$ (+-)-LINALOOL $$ (1)-3,7-DIMETHYL-1,6-OCTADIEN-3-OL $$ .BETA.-LINALOOL $$ 1, 6-OC
100 71
41
80
55 93 OH
60
40 27 80
20 53 121
31 6572 84 96109 136

20 60 100 140 180 220 260 300 340 380 420 460 500 540 580 620 660 700 740 780
Hit#:3 Entry:57896 Library:Wiley9.lib
SI:93 Formula:C10H18O CAS:22564-99-4 MolWeight:154 RetIndex:0
CompName:1,6-Octadien-3-ol, 3,7-dimethyl-, (.+-.)- (CAS) $$ 1,6-Octadien-3-ol, 3,7-dimethyl-, (.+/-.)- $$ 1,6-OCTADIEN-3-OL, 3,7-DIMETHYL- $$ 3,7-DIMETHYLOCTA-1,6-DIEN-3-OL $$ (+-)-
100 41
80
71
43
60 28
55
93
40 HO
80
20 53
32 77
65 84 96109 136

20 60 100 140 180 220 260 300 340 380 420 460 500 540 580 620 660 700 740 780
Hit#:4 Entry:58506 Library:Wiley9.lib
SI:93 Formula:C10H18O CAS:78-70-6 MolWeight:154 RetIndex:0
CompName:L-LINALOOL $$ 1,6-OCTADIEN-3-OL, 3,7-DIMETHYL- $$ 3,7-DIMETHYLOCTA-1,6-DIEN-3-OL $$ (+-)-LINALOOL $$ (1)-3,7-DIMETHYL-1,6-OCTADIEN-3-OL $$ .BETA.-LINA
100 71
43
80 93
55 OH
60
69
40 80
39
121
20 83
5159 96 136
31

20 60 100 140 180 220 260 300 340 380 420 460 500 540 580 620 660 700 740 780
Hit#:5 Entry:57956 Library:Wiley9.lib
SI:92 Formula:C10H18O CAS:78-70-6 MolWeight:154 RetIndex:0
CompName:Linalool $$ 1,6-Octadien-3-ol, 3,7-dimethyl- (CAS) $$ Linalol $$ .beta.-Linalool $$ Linalyl alcohol $$ 2,6-Dimethyl-2,7-octadien-6-ol $$ allo-Ocimenol $$ p-Linalool $$ LINOLOOL (D)
100 71
41
80
55 OH
60 93

40
80
20 53 121
65 7785 97 136

20 60 100 140 180 220 260 300 340 380 420 460 500 540 580 620 660 700 740 780
<< Target >>
Line#:4 R.Time:17.315(Scan#:2664) MassPeaks:408
RawMode:Averaged 17.310-17.320(2663-2665) BasePeak:41.00(6258)
BG Mode:Calc. from Peak Group 1 - Event 1 Scan
100 41
67
80
60 43 71
40
84
20 30 111 136 154
178 208 227 262 283 305 327 361 379 397 426 445 470 502 523 555 580 598 618 640 657 681 698 726 747 770 790

20 60 100 140 180 220 260 300 340 380 420 460 500 540 580 620 660 700 740 780
Hit#:1 Entry:58211 Library:Wiley9.lib
SI:93 Formula:C10H18O CAS:89-79-2 MolWeight:154 RetIndex:0
CompName:(-)-Isopulegol $$ Cyclohexanol, 5-methyl-2-(1-methylethenyl)-, [1R-(1.alpha.,2.beta.,5.alpha.)]- (CAS) $$ l-Isopulegol $$ Isopulegol $$ p-Menth-8-en-3-ol, (1R,3R,4S)-(-)- (CAS) $$ iso-P
100 41
80
69
60 55 81
43
40 93 OH
97 111
20 136
65 7785

20 60 100 140 180 220 260 300 340 380 420 460 500 540 580 620 660 700 740 780
Hit#:2 Entry:58215 Library:Wiley9.lib
SI:92 Formula:C10H18O CAS:89-79-2 MolWeight:154 RetIndex:0
CompName:(-)-Isopulegol $$ Cyclohexanol, 5-methyl-2-(1-methylethenyl)-, [1R-(1.alpha.,2.beta.,5.alpha.)]- (CAS) $$ l-Isopulegol $$ Isopulegol $$ p-Menth-8-en-3-ol, (1R,3R,4S)-(-)- (CAS) $$ iso-P
100 41
80
60
55 69 81
40 27 43 OH
93
20 57 111 136
85 154

20 60 100 140 180 220 260 300 340 380 420 460 500 540 580 620 660 700 740 780
Hit#:3 Entry:58574 Library:Wiley9.lib
SI:92 Formula:C10H18O CAS:21290-09-5 MolWeight:154 RetIndex:0
CompName:NEOISO(ISO)PULEGOL
100 41
OH
80
55 67
60
43 71 121
27 81 95
40 111
20 57 139
85 154

20 60 100 140 180 220 260 300 340 380 420 460 500 540 580 620 660 700 740 780
Hit#:4 Entry:58223 Library:Wiley9.lib
SI:90 Formula:C10H18O CAS:89-79-2 MolWeight:154 RetIndex:0
CompName:CYCLOHEXANOL, 5-METHYL-2-(1-METHYLETHENYL)-, [1R-(1.ALPHA.,2.BETA.,5.ALPHA.)]- $$ 2-ISOPROPENYL-5-METHYLCYCLOHEXANOL # $$ (-)-ISOPULEGOL $$ (-
100 41
80
69
55
60 27
29 56 81
40 43 95 121 OH
111 136
20 98 112 154

20 60 100 140 180 220 260 300 340 380 420 460 500 540 580 620 660 700 740 780
Hit#:5 Entry:57814 Library:Wiley9.lib
SI:89 Formula:C10H18O CAS:106-23-0 MolWeight:154 RetIndex:0
CompName:CITRONELLA $$ 6-Octenal, 3,7-dimethyl- (CAS) $$ Citronellal $$ Rhodinal $$ .beta.-Citronellal $$ 3,7-Dimethyl-6-octenal $$ 2,3-Dihydrocitral $$ 3,7 DIMETHYL 6 OCTENAL $$ Lev
100 41
69
80
60 O
55

40 27 43
95
7181
20 57 111
136 154
85

20 60 100 140 180 220 260 300 340 380 420 460 500 540 580 620 660 700 740 780
<< Target >>
Line#:5 R.Time:17.455(Scan#:2692) MassPeaks:465
RawMode:Averaged 17.450-17.460(2691-2693) BasePeak:41.00(713066)
BG Mode:Calc. from Peak Group 1 - Event 1 Scan
100 41
69
80
60
40 55
95
20 70
111
30 136 154 174 193 216 245260 281 299 320 338 359 380 411 429 458 488 505 528 545561 582 603618 641 668 691 710 731 759 778

20 60 100 140 180 220 260 300 340 380 420 460 500 540 580 620 660 700 740 780
Hit#:1 Entry:57817 Library:Wiley9.lib
SI:95 Formula:C10H18O CAS:106-23-0 MolWeight:154 RetIndex:0
CompName:CITRONELLA $$ 6-Octenal, 3,7-dimethyl- (CAS) $$ Citronellal $$ Rhodinal $$ .beta.-Citronellal $$ 3,7-Dimethyl-6-octenal $$ 2,3-Dihydrocitral $$ 3,7 DIMETHYL 6 OCTENAL $$ Lev
100 41
80 69

60 O

40 55 95
20 84 111
44 72 136 154

20 60 100 140 180 220 260 300 340 380 420 460 500 540 580 620 660 700 740 780
Hit#:2 Entry:57815 Library:Wiley9.lib
SI:95 Formula:C10H18O CAS:106-23-0 MolWeight:154 RetIndex:0
CompName:6-OCTENAL, 3,7-DIMETHYL- $$ (R)-(+)-CITRONELLAL $$ .BETA.-CITRONELLAL $$ 2,3-DIHYDROCITRAL $$ 3,7 DIMETHYL 6 OCTENAL $$ 3,7-DIMETHYL-6-OCTEN-1-AL
100 41
80 69
60 O

40 27 55
95
20 43
81 110
24 59 136 154

20 60 100 140 180 220 260 300 340 380 420 460 500 540 580 620 660 700 740 780
Hit#:3 Entry:57823 Library:Wiley9.lib
SI:94 Formula:C10H18O CAS:106-23-0 MolWeight:154 RetIndex:0
CompName:CITRONELLA $$ 6-Octenal, 3,7-dimethyl- (CAS) $$ Citronellal $$ Rhodinal $$ .beta.-Citronellal $$ 3,7-Dimethyl-6-octenal $$ 2,3-Dihydrocitral $$ 3,7 DIMETHYL 6 OCTENAL $$ Lev
100 41
80
69
60 O

55
40 95
43
27
20 57 71
84 111 136 154
85

20 60 100 140 180 220 260 300 340 380 420 460 500 540 580 620 660 700 740 780
Hit#:4 Entry:57822 Library:Wiley9.lib
SI:93 Formula:C10H18O CAS:106-23-0 MolWeight:154 RetIndex:0
CompName:CITRONELLA $$ 6-Octenal, 3,7-dimethyl- (CAS) $$ Citronellal $$ Rhodinal $$ .beta.-Citronellal $$ 3,7-Dimethyl-6-octenal $$ 2,3-Dihydrocitral $$ 3,7 DIMETHYL 6 OCTENAL $$ Lev
100 41
80 69

60 O

55 95
40
43
20 57 71
84 111
85 136 154

20 60 100 140 180 220 260 300 340 380 420 460 500 540 580 620 660 700 740 780
Hit#:5 Entry:57819 Library:Wiley9.lib
SI:92 Formula:C10H18O CAS:106-23-0 MolWeight:154 RetIndex:0
CompName:CITRONELLA $$ 6-Octenal, 3,7-dimethyl- (CAS) $$ Citronellal $$ Rhodinal $$ .beta.-Citronellal $$ 3,7-Dimethyl-6-octenal $$ 2,3-Dihydrocitral $$ 3,7 DIMETHYL 6 OCTENAL $$ Lev
100 41
80 69

60 O
55
40 28
43 95
112
20 59 71 83 121 139154

20 60 100 140 180 220 260 300 340 380 420 460 500 540 580 620 660 700 740 780
<< Target >>
Line#:6 R.Time:17.695(Scan#:2740) MassPeaks:409
RawMode:Averaged 17.690-17.700(2739-2741) BasePeak:41.00(2630)
BG Mode:Calc. from Peak Group 1 - Event 1 Scan
100 41
80 69
60 55
32 71
40 84
20 98 121
139154 176 206 226 248 265 284 306 330 363 380 432 450 474 501 522537 565 586 606 625 642 660675 694709 733 752 772 791
405

20 60 100 140 180 220 260 300 340 380 420 460 500 540 580 620 660 700 740 780
Hit#:1 Entry:58211 Library:Wiley9.lib
SI:91 Formula:C10H18O CAS:89-79-2 MolWeight:154 RetIndex:0
CompName:(-)-Isopulegol $$ Cyclohexanol, 5-methyl-2-(1-methylethenyl)-, [1R-(1.alpha.,2.beta.,5.alpha.)]- (CAS) $$ l-Isopulegol $$ Isopulegol $$ p-Menth-8-en-3-ol, (1R,3R,4S)-(-)- (CAS) $$ iso-P
100 41
80
69
60 55 81
43
40 93 OH
97 111
20 136
65 7785

20 60 100 140 180 220 260 300 340 380 420 460 500 540 580 620 660 700 740 780
Hit#:2 Entry:58215 Library:Wiley9.lib
SI:90 Formula:C10H18O CAS:89-79-2 MolWeight:154 RetIndex:0
CompName:(-)-Isopulegol $$ Cyclohexanol, 5-methyl-2-(1-methylethenyl)-, [1R-(1.alpha.,2.beta.,5.alpha.)]- (CAS) $$ l-Isopulegol $$ Isopulegol $$ p-Menth-8-en-3-ol, (1R,3R,4S)-(-)- (CAS) $$ iso-P
100 41
80
60
55 69 81
40 27 43 OH
93
20 57 111 136
85 154

20 60 100 140 180 220 260 300 340 380 420 460 500 540 580 620 660 700 740 780
Hit#:3 Entry:58574 Library:Wiley9.lib
SI:90 Formula:C10H18O CAS:21290-09-5 MolWeight:154 RetIndex:0
CompName:NEOISO(ISO)PULEGOL
100 41
OH
80
55 67
60
43 71 121
27 81 95
40 111
20 57 139
85 154

20 60 100 140 180 220 260 300 340 380 420 460 500 540 580 620 660 700 740 780
Hit#:4 Entry:57814 Library:Wiley9.lib
SI:89 Formula:C10H18O CAS:106-23-0 MolWeight:154 RetIndex:0
CompName:CITRONELLA $$ 6-Octenal, 3,7-dimethyl- (CAS) $$ Citronellal $$ Rhodinal $$ .beta.-Citronellal $$ 3,7-Dimethyl-6-octenal $$ 2,3-Dihydrocitral $$ 3,7 DIMETHYL 6 OCTENAL $$ Lev
100 41
69
80
60 O
55

40 27 43
95
7181
20 57 111
136 154
85

20 60 100 140 180 220 260 300 340 380 420 460 500 540 580 620 660 700 740 780
Hit#:5 Entry:58223 Library:Wiley9.lib
SI:88 Formula:C10H18O CAS:89-79-2 MolWeight:154 RetIndex:0
CompName:CYCLOHEXANOL, 5-METHYL-2-(1-METHYLETHENYL)-, [1R-(1.ALPHA.,2.BETA.,5.ALPHA.)]- $$ 2-ISOPROPENYL-5-METHYLCYCLOHEXANOL # $$ (-)-ISOPULEGOL $$ (-
100 41
80
69
55
60 27
29 56 81
40 43 95 121 OH
111 136
20 98 112 154

20 60 100 140 180 220 260 300 340 380 420 460 500 540 580 620 660 700 740 780
<< Target >>
Line#:7 R.Time:19.910(Scan#:3183) MassPeaks:424
RawMode:Averaged 19.905-19.915(3182-3184) BasePeak:41.00(215352)
BG Mode:Calc. from Peak Group 1 - Event 1 Scan
100 41
80 69

60
55
40 81
20 95
30 109 138 156 178 198 215 234 265 285 302317 335 352 372 389 405 426 460475 500 526 549 570 591 613 643 669 693709 730 752 780

20 60 100 140 180 220 260 300 340 380 420 460 500 540 580 620 660 700 740 780
Hit#:1 Entry:61708 Library:Wiley9.lib
SI:94 Formula:C10H20O CAS:106-22-9 MolWeight:156 RetIndex:0
CompName:.beta.-Citronellol $$ 6-Octen-1-ol, 3,7-dimethyl- (CAS) $$ Citronellol $$ Rodinol $$ Cephrol $$ 3,7-Dimethyl-6-octen-1-ol $$ 2,3-Dihydrogeraniol $$ BETA-CITRONELLOL $$ D-CITR
100 41
80 69
60 HO
55
40 81
95
27 43 71
20 57 109
85 99 138 156

20 60 100 140 180 220 260 300 340 380 420 460 500 540 580 620 660 700 740 780
Hit#:2 Entry:61702 Library:Wiley9.lib
SI:94 Formula:C10H20O CAS:106-22-9 MolWeight:156 RetIndex:0
CompName:.beta.-Citronellol $$ 6-Octen-1-ol, 3,7-dimethyl- (CAS) $$ Citronellol $$ Rodinol $$ Cephrol $$ 3,7-Dimethyl-6-octen-1-ol $$ 2,3-Dihydrogeraniol $$ BETA-CITRONELLOL $$ D-CITR
100 41
80 69
60 HO

55
40 81
43 71 95
20 27 57 109 156
86 138

20 60 100 140 180 220 260 300 340 380 420 460 500 540 580 620 660 700 740 780
Hit#:3 Entry:61703 Library:Wiley9.lib
SI:94 Formula:C10H20O CAS:106-22-9 MolWeight:156 RetIndex:0
CompName:.beta.-Citronellol $$ 6-Octen-1-ol, 3,7-dimethyl- (CAS) $$ Citronellol $$ Rodinol $$ Cephrol $$ 3,7-Dimethyl-6-octen-1-ol $$ 2,3-Dihydrogeraniol $$ BETA-CITRONELLOL $$ D-CITR
100 41
69
80
60 HO
55
71
40 28 81
95
29 43
20 57 109 138 156
85

20 60 100 140 180 220 260 300 340 380 420 460 500 540 580 620 660 700 740 780
Hit#:4 Entry:61699 Library:Wiley9.lib
SI:94 Formula:C10H20O CAS:106-22-9 MolWeight:156 RetIndex:0
CompName:6-OCTEN-1-OL, 3,7-DIMETHYL- $$ (R)-(+)-CITRONELLOL $$ .BETA.-CITRONELLOL $$ 2,3-DIHYDROGERANIOL $$ 2,6-DIMETHYL-2-OCTEN-8-OL $$ 3, 7-DIMETHYL-6-OC
100 41
69
80
60 HO
55
82
40
71 95
27 43
20 57 109
85 99 138 156

20 60 100 140 180 220 260 300 340 380 420 460 500 540 580 620 660 700 740 780
Hit#:5 Entry:61700 Library:Wiley9.lib
SI:93 Formula:C10H20O CAS:106-22-9 MolWeight:156 RetIndex:0
CompName:.beta.-Citronellol $$ 6-Octen-1-ol, 3,7-dimethyl- (CAS) $$ Citronellol $$ Rodinol $$ Cephrol $$ 3,7-Dimethyl-6-octen-1-ol $$ 2,3-Dihydrogeraniol $$ BETA-CITRONELLOL $$ D-CITR
100 41
80 69
60 55 HO

40 67 82
27 95
20
45 109 138 156
85

20 60 100 140 180 220 260 300 340 380 420 460 500 540 580 620 660 700 740 780
<< Target >>
Line#:8 R.Time:20.010(Scan#:3203) MassPeaks:406
RawMode:Averaged 20.005-20.015(3202-3204) BasePeak:41.00(35886)
BG Mode:Calc. from Peak Group 1 - Event 1 Scan
100 41
80
69
60
40
20 53 83 94 109
30 134 157 182 207 236 258274 293 310325 345 376 400 417 439 469 487 517 537 556572 591 624 642 669 699 716 737 767

20 60 100 140 180 220 260 300 340 380 420 460 500 540 580 620 660 700 740 780
Hit#:1 Entry:54071 Library:Wiley9.lib
SI:94 Formula:C10H16O CAS:106-26-3 MolWeight:152 RetIndex:0
CompName:Z-Citral $$ 2,6-Octadienal, 3,7-dimethyl-, (Z)- (CAS) $$ Neral $$ .beta.-Citral $$ cis-Citral $$ Citral b $$ cis-3,7-Dimethyl-2,6-octadienal $$ (Z)-3,7-Dimethyl-2,6-octadienal $$ citral-b $$
100 41
80 H
60 69
O
40
27
20 94
43 59 77 96 109 134

20 60 100 140 180 220 260 300 340 380 420 460 500 540 580 620 660 700 740 780
Hit#:2 Entry:54079 Library:Wiley9.lib
SI:94 Formula:C10H16O CAS:106-26-3 MolWeight:152 RetIndex:0
CompName:Z-Citral $$ 2,6-Octadienal, 3,7-dimethyl-, (Z)- (CAS) $$ Neral $$ .beta.-Citral $$ cis-Citral $$ Citral b $$ cis-3,7-Dimethyl-2,6-octadienal $$ (Z)-3,7-Dimethyl-2,6-octadienal $$ citral-b $$
100 41
80 H
60 69
O
40 39

20 53 67
45 77 91 107

20 60 100 140 180 220 260 300 340 380 420 460 500 540 580 620 660 700 740 780
Hit#:3 Entry:54068 Library:Wiley9.lib
SI:93 Formula:C10H16O CAS:5392-40-5 MolWeight:152 RetIndex:0
CompName:Citral $$ 2,6-Octadienal, 3,7-dimethyl- (CAS) $$ 3,7-Dimethyl-2,6-octadienal $$ 3,7-Dimethyl-1-2,6-octadienal $$ Citral,c&t $$ cis,trans-Citral $$ Geranial $$ NCI-C56348 $$ 3,7-Dimeth
100 41
69
80 H
60
O
40
27 39
84
20 53 67 81 94 109
24 96 137152

20 60 100 140 180 220 260 300 340 380 420 460 500 540 580 620 660 700 740 780
Hit#:4 Entry:54058 Library:Wiley9.lib
SI:93 Formula:C10H16O CAS:106-26-3 MolWeight:152 RetIndex:0
CompName:2,6-OCTADIENAL, 3,7-DIMETHYL- $$ 2,6-OCTADIENAL, 3,7-DIMETHYL-, (Z)- $$ (2E)-3,7-DIMETHYL-2,6-OCTADIENAL # $$ (2E)-3,7-DIMETHYL-2,6-OCTADIENAL $$ (2E)-
100 41
69
80 H
60
O
40
27 39
84
20 53 67 81 94 109
24 96 137152

20 60 100 140 180 220 260 300 340 380 420 460 500 540 580 620 660 700 740 780
Hit#:5 Entry:54066 Library:Wiley9.lib
SI:92 Formula:C10H16O CAS:5392-40-5 MolWeight:152 RetIndex:0
CompName:Citral $$ 2,6-Octadienal, 3,7-dimethyl- (CAS) $$ 3,7-Dimethyl-2,6-octadienal $$ 3,7-Dimethyl-1-2,6-octadienal $$ Citral,c&t $$ cis,trans-Citral $$ Geranial $$ NCI-C56348 $$ 3,7-Dimeth
100 41
69
80
60 O

40
84
20 27 94
43 59 70 83 109
137152

20 60 100 140 180 220 260 300 340 380 420 460 500 540 580 620 660 700 740 780
<< Target >>
Line#:9 R.Time:20.655(Scan#:3332) MassPeaks:416
RawMode:Averaged 20.650-20.660(3331-3333) BasePeak:69.05(804860)
BG Mode:Calc. from Peak Group 1 - Event 1 Scan
100 41 69
80
60
40
20 43 70 93
30 111 136 154 174 206 224 249 269 297 315 349 377 402 424 443 471 501 521 541 558 583 608 627 647 665 698 723738 756 776

20 60 100 140 180 220 260 300 340 380 420 460 500 540 580 620 660 700 740 780
Hit#:1 Entry:57924 Library:Wiley9.lib
SI:97 Formula:C10H18O CAS:106-24-1 MolWeight:154 RetIndex:0
CompName:trans-Geraniol $$ 2,6-Octadien-1-ol, 3,7-dimethyl-, (E)- (CAS) $$ Guaniol $$ Lemonol $$ Geraniol $$ Geranyl alcohol $$ 2,6-Dimethyl-2,6-octadien-8-ol $$ 2,6-dimethyloctane-2,6-dien-8
100 69
41
80
60 HO

40
20
55
44 77 91 105 123 154

20 60 100 140 180 220 260 300 340 380 420 460 500 540 580 620 660 700 740 780
Hit#:2 Entry:57921 Library:Wiley9.lib
SI:95 Formula:C10H18O CAS:106-24-1 MolWeight:154 RetIndex:0
CompName:trans-Geraniol $$ 2,6-Octadien-1-ol, 3,7-dimethyl-, (E)- (CAS) $$ Guaniol $$ Lemonol $$ Geraniol $$ Geranyl alcohol $$ 2,6-Dimethyl-2,6-octadien-8-ol $$ 2,6-dimethyloctane-2,6-dien-8
100 41 69
80
60 HO

40
20 27
43
57 71 84 111 136 154

20 60 100 140 180 220 260 300 340 380 420 460 500 540 580 620 660 700 740 780
Hit#:3 Entry:57925 Library:Wiley9.lib
SI:95 Formula:C10H18O CAS:106-24-1 MolWeight:154 RetIndex:0
CompName:trans-Geraniol $$ 2,6-Octadien-1-ol, 3,7-dimethyl-, (E)- (CAS) $$ Guaniol $$ Lemonol $$ Geraniol $$ Geranyl alcohol $$ 2,6-Dimethyl-2,6-octadien-8-ol $$ 2,6-dimethyloctane-2,6-dien-8
100 41 69
80
60 HO

40
20 43
57 79 91 111

20 60 100 140 180 220 260 300 340 380 420 460 500 540 580 620 660 700 740 780
Hit#:4 Entry:58573 Library:Wiley9.lib
SI:94 Formula:C10H18O CAS:106-24-1 MolWeight:154 RetIndex:0
CompName:GERANIOL $$ 2,6-OCTADIEN-1-OL, 3,7-DIMETHYL-, (E)- $$ 3,7-DIMETHYLOCTA-2,6-DIEN-1-OL $$ (2E)-3,7-DIMETHYL-2,6-OCTADIEN-1-OL # $$ (2E)-3,7-DIMETHYL-2,6-O
100 41 69
80
60 HO

40
20 29 93
43 55
31 65 77 97 111 136

20 60 100 140 180 220 260 300 340 380 420 460 500 540 580 620 660 700 740 780
Hit#:5 Entry:57916 Library:Wiley9.lib
SI:93 Formula:C10H18O CAS:106-24-1 MolWeight:154 RetIndex:0
CompName:2,6-OCTADIEN-1-OL, 3,7-DIMETHYL-, (E)- $$ 3,7-DIMETHYLOCTA-2,6-DIEN-1-OL $$ (2E)-3,7-DIMETHYL-2,6-OCTADIEN-1-OL # $$ (2E)-3,7-DIMETHYL-2,6-OCTADIEN-1-O
100 69
80
41
60 HO

40
20
27 43 55 71 84 111 136 154

20 60 100 140 180 220 260 300 340 380 420 460 500 540 580 620 660 700 740 780
<< Target >>
Line#:10 R.Time:20.865(Scan#:3374) MassPeaks:481
RawMode:Averaged 20.860-20.870(3373-3375) BasePeak:41.00(77952)
BG Mode:Calc. from Peak Group 1 - Event 1 Scan
100 41 69
80
60
40
20 53 83 109 137
31 165 190 209 229 263 279 305 321337 369385 415 440 462 492 516 538 563 583 602 625 646 663 680 710 731 748 775

20 60 100 140 180 220 260 300 340 380 420 460 500 540 580 620 660 700 740 780
Hit#:1 Entry:54078 Library:Wiley9.lib
SI:94 Formula:C10H16O CAS:5392-40-5 MolWeight:152 RetIndex:0
CompName:Citral $$ 2,6-Octadienal, 3,7-dimethyl- (CAS) $$ 3,7-Dimethyl-2,6-octadienal $$ 3,7-Dimethyl-1-2,6-octadienal $$ Citral,c&t $$ cis,trans-Citral $$ Geranial $$ NCI-C56348 $$ 3,7-Dimeth
100 41 69
80
60 O

40
20 84
43 5565 77 94 109 137

20 60 100 140 180 220 260 300 340 380 420 460 500 540 580 620 660 700 740 780
Hit#:2 Entry:54058 Library:Wiley9.lib
SI:94 Formula:C10H16O CAS:106-26-3 MolWeight:152 RetIndex:0
CompName:2,6-OCTADIENAL, 3,7-DIMETHYL- $$ 2,6-OCTADIENAL, 3,7-DIMETHYL-, (Z)- $$ (2E)-3,7-DIMETHYL-2,6-OCTADIENAL # $$ (2E)-3,7-DIMETHYL-2,6-OCTADIENAL $$ (2E)-
100 41
69
80 H
60
O
40
27 39
84
20 53 67 81 94 109
24 96 137152

20 60 100 140 180 220 260 300 340 380 420 460 500 540 580 620 660 700 740 780
Hit#:3 Entry:54043 Library:Wiley9.lib
SI:94 Formula:C10H16O CAS:141-27-5 MolWeight:152 RetIndex:0
CompName:E-Citral $$ 2,6-Octadienal, 3,7-dimethyl-, (E)- (CAS) $$ Geranial $$ trans-Citral $$ Citral a $$ Citral-a $$ (E)-Citral $$ Geranaldehyde $$ .alpha.-Citral $$ trans-3,7-Dimethyl-2,6-octadien
100 41
69 O
80
H
60
40
84
20 27
94
29 42 53 70 83 109 132 152

20 60 100 140 180 220 260 300 340 380 420 460 500 540 580 620 660 700 740 780
Hit#:4 Entry:54068 Library:Wiley9.lib
SI:94 Formula:C10H16O CAS:5392-40-5 MolWeight:152 RetIndex:0
CompName:Citral $$ 2,6-Octadienal, 3,7-dimethyl- (CAS) $$ 3,7-Dimethyl-2,6-octadienal $$ 3,7-Dimethyl-1-2,6-octadienal $$ Citral,c&t $$ cis,trans-Citral $$ Geranial $$ NCI-C56348 $$ 3,7-Dimeth
100 41
69
80 H
60
O
40
27 39
84
20 53 67 81 94 109
24 96 137152

20 60 100 140 180 220 260 300 340 380 420 460 500 540 580 620 660 700 740 780
Hit#:5 Entry:54053 Library:Wiley9.lib
SI:94 Formula:C10H16O CAS:141-27-5 MolWeight:152 RetIndex:0
CompName:E-Citral $$ 2,6-Octadienal, 3,7-dimethyl-, (E)- (CAS) $$ Geranial $$ trans-Citral $$ Citral a $$ Citral-a $$ (E)-Citral $$ Geranaldehyde $$ .alpha.-Citral $$ trans-3,7-Dimethyl-2,6-octadien
100 41 O
80 69
H
60
40
20 84
43 5565 77 94 109 137

20 60 100 140 180 220 260 300 340 380 420 460 500 540 580 620 660 700 740 780
<< Target >>
Line#:11 R.Time:23.360(Scan#:3873) MassPeaks:380
RawMode:Averaged 23.355-23.365(3872-3874) BasePeak:163.95(1538)
BG Mode:Calc. from Peak Group 1 - Event 1 Scan
100 164
80 55
77
60 91
65 103
40 149
30
20 121
181 204 224 247 276 302 332 356 388 412 434 460 489 515 533 571 590 614 634 655 681 711 740 768 786

10 50 90 130 170 210 250 290 330 370 410 450 490 530 570 610 650 690 730 770
Hit#:1 Entry:72308 Library:Wiley9.lib
SI:87 Formula:C10H12O2 CAS:97-53-0 MolWeight:164 RetIndex:0
CompName:Phenol, 2-methoxy-4-(2-propenyl)- (CAS) $$ Eugenol $$ 1-(2-PROPENYL)-4-HYDROXY-3-METHOXYBENZENE $$ Engenol $$ p-Eugenol $$ Eugenic acid $$ 4-Allylguaiacol $$ p-A
100 164
OH
80
60 77
55 91103 149
40 39 51 O
121
65
20 27
94 165
29 74 115 147

10 50 90 130 170 210 250 290 330 370 410 450 490 530 570 610 650 690 730 770
Hit#:2 Entry:72414 Library:Wiley9.lib
SI:83 Formula:C10H12O2 CAS:19784-98-6 MolWeight:164 RetIndex:0
CompName:Phenol, 2-methoxy-5-(1-propenyl)-, (E)- (CAS) $$ Phenol, 2-methoxy-5-propenyl-, (E)- (CAS) $$ trans-m-Propenyl guaiacol $$ 3157101009 TRANS - ISOEUGENOL $$ 2-Methoxy-5-[(1
100 164
80 HO

60 55
77 149
40 O
39 51 65 103 121
91
20 79 137
27 94 115 150

10 50 90 130 170 210 250 290 330 370 410 450 490 530 570 610 650 690 730 770
Hit#:3 Entry:155406 Library:Wiley9.lib
SI:82 Formula:C12H14O3 CAS:93-28-7 MolWeight:206 RetIndex:0
CompName:Phenol, 2-methoxy-4-(2-propenyl)-, acetate (CAS) $$ Aceteugenol $$ Acetyleugenol $$ Eugenol acetate $$ Eugenyl acetate $$ 1,3,4-Eugenol acetate $$ Phenol, 4-allyl-2-methoxy-, acetate
100 164
43
80 O
91
60
77
103 149 O
40 65 131
39 55 121
20 O
15 27 115 163 206

10 50 90 130 170 210 250 290 330 370 410 450 490 530 570 610 650 690 730 770
Hit#:4 Entry:72568 Library:Wiley9.lib
SI:82 Formula:C10H12O2 CAS:1941-12-4 MolWeight:164 RetIndex:0
CompName:Phenol, 2-methoxy-3-(2-propenyl)- (CAS) $$ 3-Allyl-2-methoxyphenol $$ 3-ALLYL-2-METHOXYPHENOL # $$ Phenol, 3-allyl-2-methoxy- (CAS) $$ 3-Allylguaiacol $$ Guaiacol, 3-ally
100 164
OH
80
60 O
77 149
40 103
55 91 121 137
20 39 51 65
78 94
27 150
115

10 50 90 130 170 210 250 290 330 370 410 450 490 530 570 610 650 690 730 770
Hit#:5 Entry:72415 Library:Wiley9.lib
SI:81 Formula:C10H12O2 CAS:19784-98-6 MolWeight:164 RetIndex:0
CompName:Phenol, 2-methoxy-5-(1-propenyl)-, (E)- (CAS) $$ Phenol, 2-methoxy-5-propenyl-, (E)- (CAS) $$ trans-m-Propenyl guaiacol $$ 3157101009 TRANS - ISOEUGENOL $$ 2-Methoxy-5-[(1
100 164
80 HO

60
55 149
40 77
91103 121
O
39
20 65
27 102 119 147
75 180

10 50 90 130 170 210 250 290 330 370 410 450 490 530 570 610 650 690 730 770
<< Target >>
Line#:12 R.Time:23.550(Scan#:3911) MassPeaks:447
RawMode:Averaged 23.545-23.555(3910-3912) BasePeak:41.00(31663)
BG Mode:Calc. from Peak Group 1 - Event 1 Scan
100 41
67
80
60 81

40 95

20 109 138
31 155171 189 222 240 258 293 313 331347 373 397 415 438 458 485 514 532548 565 592608 641 664680 697 715 738 757 775 793

20 60 100 140 180 220 260 300 340 380 420 460 500 540 580 620 660 700 740 780
Hit#:1 Entry:138727 Library:Wiley9.lib
SI:94 Formula:C12H22O2 CAS:150-84-5 MolWeight:198 RetIndex:0
CompName:Citronellyl acetate $$ 6-Octen-1-ol, 3,7-dimethyl-, acetate (CAS) $$ Citronellol acetate (CAS) $$ Natural rhodinol, acetylated $$ 3,7-Dimethyl-6-octenyl acetate $$ .beta.-Citronellyl acetat
100
41
80 69
O
60 81
55 95
40 O
123
20 27 109 138
5361 96
31 73 84

20 60 100 140 180 220 260 300 340 380 420 460 500 540 580 620 660 700 740 780
Hit#:2 Entry:138728 Library:Wiley9.lib
SI:93 Formula:C12H22O2 CAS:150-84-5 MolWeight:198 RetIndex:0
CompName:Citronellyl acetate $$ 6-Octen-1-ol, 3,7-dimethyl-, acetate (CAS) $$ Citronellol acetate (CAS) $$ Natural rhodinol, acetylated $$ 3,7-Dimethyl-6-octenyl acetate $$ .beta.-Citronellyl acetat
100 41
80 69
81 O
60 95
55 123
40 138
O
109
20 53
61 73 139
85 97

20 60 100 140 180 220 260 300 340 380 420 460 500 540 580 620 660 700 740 780
Hit#:3 Entry:138723 Library:Wiley9.lib
SI:93 Formula:C12H22O2 CAS:150-84-5 MolWeight:198 RetIndex:0
CompName:Citronellyl acetate $$ 6-Octen-1-ol, 3,7-dimethyl-, acetate (CAS) $$ Citronellol acetate (CAS) $$ Natural rhodinol, acetylated $$ 3,7-Dimethyl-6-octenyl acetate $$ .beta.-Citronellyl acetat
100 41
80 69
O
60 81
55 95
40 123
O

20 109 138
27 53
31 61 73 87 101 139

20 60 100 140 180 220 260 300 340 380 420 460 500 540 580 620 660 700 740 780
Hit#:4 Entry:138725 Library:Wiley9.lib
SI:93 Formula:C12H22O2 CAS:150-84-5 MolWeight:198 RetIndex:0
CompName:Citronellyl acetate $$ 6-Octen-1-ol, 3,7-dimethyl-, acetate (CAS) $$ Citronellol acetate (CAS) $$ Natural rhodinol, acetylated $$ 3,7-Dimethyl-6-octenyl acetate $$ .beta.-Citronellyl acetat
100 41 69
80
81
95 O
60
28 55
40 123
O

20 109 138
5361 96
32
7784 137

20 60 100 140 180 220 260 300 340 380 420 460 500 540 580 620 660 700 740 780
Hit#:5 Entry:138731 Library:Wiley9.lib
SI:92 Formula:C12H22O2 CAS:150-84-5 MolWeight:198 RetIndex:0
CompName:Citronellyl acetate $$ 6-Octen-1-ol, 3,7-dimethyl-, acetate (CAS) $$ Citronellol acetate (CAS) $$ Natural rhodinol, acetylated $$ 3,7-Dimethyl-6-octenyl acetate $$ .beta.-Citronellyl acetat
100 41 69
80 81
95 O
60
55
40 123
O

20 109 138
5361
97 139

20 60 100 140 180 220 260 300 340 380 420 460 500 540 580 620 660 700 740 780
<< Target >>
Line#:13 R.Time:24.275(Scan#:4056) MassPeaks:415
RawMode:Averaged 24.270-24.280(4055-4057) BasePeak:69.05(85613)
BG Mode:Calc. from Peak Group 1 - Event 1 Scan
100 69
41
80
43
60
40
93
20 80
30 107 136 153 171187202 236 260 282 304 329 349 369 386 409424 456471 496 515 539 563 597613628 645 662 690 713 731 767 787

20 60 100 140 180 220 260 300 340 380 420 460 500 540 580 620 660 700 740 780
Hit#:1 Entry:134304 Library:Wiley9.lib
SI:95 Formula:C12H20O2 CAS:105-87-3 MolWeight:196 RetIndex:0
CompName:Geranyl acetate $$ 2,6-Octadien-1-ol, 3,7-dimethyl-, acetate, (E)- (CAS) $$ Geraniol acetate (CAS) $$ Bay pine (oyster) oil $$ Acetic acid geraniol ester $$ trans-3,7-Dimethyl-2,6-octadien
100 69
41
80
O
60
40 O
93
20 27 53 121
57 77 105 127 154

20 60 100 140 180 220 260 300 340 380 420 460 500 540 580 620 660 700 740 780
Hit#:2 Entry:134303 Library:Wiley9.lib
SI:95 Formula:C12H20O2 CAS:105-87-3 MolWeight:196 RetIndex:0
CompName:Geranyl acetate $$ 2,6-Octadien-1-ol, 3,7-dimethyl-, acetate, (E)- (CAS) $$ Geraniol acetate (CAS) $$ Bay pine (oyster) oil $$ Acetic acid geraniol ester $$ trans-3,7-Dimethyl-2,6-octadien
100 69
80
43
O
60
40 O
93
20 121136
44 77 92 105 154

20 60 100 140 180 220 260 300 340 380 420 460 500 540 580 620 660 700 740 780
Hit#:3 Entry:134300 Library:Wiley9.lib
SI:94 Formula:C12H20O2 CAS:105-87-3 MolWeight:196 RetIndex:0
CompName:2,6-OCTADIEN-1-OL, 3,7-DIMETHYL-, ACETATE $$ 2,6-OCTADIEN-1-OL, 3,7-DIMETHYL-, ACETATE, (E)- $$ (2E)-3,7-DIMETHYL-2,6-OCTADIENYL ACETATE # $$ (2E)-3,7-D
100 69
80
41 O
60
40 93
O

20 121136
27 53 77 105 154

20 60 100 140 180 220 260 300 340 380 420 460 500 540 580 620 660 700 740 780
Hit#:4 Entry:134293 Library:Wiley9.lib
SI:94 Formula:C12H20O2 CAS:141-12-8 MolWeight:196 RetIndex:0
CompName:Neryl acetate $$ 2,6-Octadien-1-ol, 3,7-dimethyl-, acetate, (Z)- (CAS) $$ Nerol acetate (CAS) $$ Linalyl, neryl, geranyl acetates, mixture $$ (2Z)-3,7-Dimethyl-2,6-octadienyl acetate $$ (2
100 69
80 41
O
60 43

40 93 O

20 27 53
80
121
7785 105 127 154

20 60 100 140 180 220 260 300 340 380 420 460 500 540 580 620 660 700 740 780
Hit#:5 Entry:134605 Library:Wiley9.lib
SI:93 Formula:C12H20O2 CAS:0-00-0 MolWeight:196 RetIndex:0
CompName:NERYL ACETATE
100 69
80 41
43
60 O
40 93
O
20 80 121136
53
57 7785 105 127 154

20 60 100 140 180 220 260 300 340 380 420 460 500 540 580 620 660 700 740 780
<< Target >>
Line#:14 R.Time:25.000(Scan#:4201) MassPeaks:461
RawMode:Averaged 24.995-25.005(4200-4202) BasePeak:67.00(6396)
BG Mode:Calc. from Peak Group 1 - Event 1 Scan
100 41 67
80 81 93

60 55
107
40
147
20 119
175 204 226
30 251 273 290306 329 349 367383 403 430 450466 487 510 533 550 570 593 624640 659 685701 727742 768784

20 60 100 140 180 220 260 300 340 380 420 460 500 540 580 620 660 700 740 780
Hit#:1 Entry:151829 Library:Wiley9.lib
SI:93 Formula:C15H24 CAS:33880-83-0 MolWeight:204 RetIndex:0
CompName:2,4-DIISOPROPENYL-1-METHYL-1-VINYL-CYCLOHEXANE $$ 2,4-DIISOPROPENYL-1-METHYL-1-VINYLCYCLOHEXANE # $$ (- )-BETE-ELEMENE $$ (1ALPHA,2BETA,4
100 41 68 81
93
80
60 39 53

107121
40 27
95
20 65 119
133
148
175

20 60 100 140 180 220 260 300 340 380 420 460 500 540 580 620 660 700 740 780
Hit#:2 Entry:152532 Library:Wiley9.lib
SI:93 Formula:C15H24 CAS:110823-68-2 MolWeight:204 RetIndex:0
CompName:Cyclohexane, 1-ethenyl-1-methyl-2,4-bis(1-methylethenyl)- (CAS) $$ 2,4-Diisopropenyl-1-methyl-1-vinylcyclohexane $$ 2,4-DIISOPROPENYL-1-METHYL-1-VINYLCYCLOHEXANE
100 41 68 81
93
80
60 39 53

107121
40 27
95
20 65 119
133
148
175

20 60 100 140 180 220 260 300 340 380 420 460 500 540 580 620 660 700 740 780
Hit#:3 Entry:151819 Library:Wiley9.lib
SI:92 Formula:C15H24 CAS:515-13-9 MolWeight:204 RetIndex:0
CompName:(-)-.beta.-Elemene $$ Cyclohexane, 1-ethenyl-1-methyl-2,4-bis(1-methylethenyl)-, [1S-(1.alpha.,2.beta.,4.beta.)]- (CAS) $$ CIS-1,3-DIISOPROPENYL-TRANS-4-VINYL-4-METHYLCY
100 41 81
68
80
93
60 53
27 107
40 91
147 189
20 43
123 204
162

20 60 100 140 180 220 260 300 340 380 420 460 500 540 580 620 660 700 740 780
Hit#:4 Entry:152330 Library:Wiley9.lib
SI:92 Formula:C15H24 CAS:28387-44-2 MolWeight:204 RetIndex:0
CompName:germacrene A (CAS) $$ 1,5-Cyclodecadiene, 1,5-dimethyl-8-(1-methylethenyl)-, [S-(E,E)]- (CAS) $$ Germacra-3,9,11-triene, (E,E)- (CAS) $$ (-)-Germacrene A $$ 1,5-CYCLODECADIEN
100 68
41
80 93
81
107
60 53

91
40 29 119
133 161 189
20 43 122
204
162

20 60 100 140 180 220 260 300 340 380 420 460 500 540 580 620 660 700 740 780
Hit#:5 Entry:151822 Library:Wiley9.lib
SI:91 Formula:C15H24 CAS:515-13-9 MolWeight:204 RetIndex:0
CompName:(-)-.beta.-Elemene $$ Cyclohexane, 1-ethenyl-1-methyl-2,4-bis(1-methylethenyl)-, [1S-(1.alpha.,2.beta.,4.beta.)]- (CAS) $$ CIS-1,3-DIISOPROPENYL-TRANS-4-VINYL-4-METHYLCY
100 81
41 68
93
80
60
53 107
40 39 121
27 94
20 65 119133148 189
175

20 60 100 140 180 220 260 300 340 380 420 460 500 540 580 620 660 700 740 780
<< Target >>
Line#:15 R.Time:25.780(Scan#:4357) MassPeaks:468
RawMode:Averaged 25.775-25.785(4356-4358) BasePeak:41.00(14417)
BG Mode:Calc. from Peak Group 1 - Event 1 Scan
100 41
80
69
60
79 91
40 55
105
20 120 147
31 175 204 230246 278 306 333 362378 401 430446 463479 512 545 566 585 602 627642 662 684 705 738 764 785

20 60 100 140 180 220 260 300 340 380 420 460 500 540 580 620 660 700 740 780
Hit#:1 Entry:151915 Library:Wiley9.lib
SI:94 Formula:C15H24 CAS:87-44-5 MolWeight:204 RetIndex:0
CompName:trans-Caryophyllene $$ Bicyclo[7.2.0]undec-4-ene, 4,11,11-trimethyl-8-methylene-, [1R-(1R*,4E,9S*)]- (CAS) $$ l-Caryophyllene $$ (-)-Caryophyllene $$ Caryophyllene $$ .beta.-Caryop
100 41
80 69
93
60 79

40 55
77 105 133
107
20 43
147
189

20 60 100 140 180 220 260 300 340 380 420 460 500 540 580 620 660 700 740 780
Hit#:2 Entry:151905 Library:Wiley9.lib
SI:93 Formula:C15H24 CAS:87-44-5 MolWeight:204 RetIndex:0
CompName:trans-Caryophyllene $$ Bicyclo[7.2.0]undec-4-ene, 4,11,11-trimethyl-8-methylene-, [1R-(1R*,4E,9S*)]- (CAS) $$ l-Caryophyllene $$ (-)-Caryophyllene $$ Caryophyllene $$ .beta.-Caryop
100 41
80
60
40 91
69
53 105 133
20 43 120
147 175

20 60 100 140 180 220 260 300 340 380 420 460 500 540 580 620 660 700 740 780
Hit#:3 Entry:151914 Library:Wiley9.lib
SI:92 Formula:C15H24 CAS:87-44-5 MolWeight:204 RetIndex:0
CompName:trans-Caryophyllene $$ Bicyclo[7.2.0]undec-4-ene, 4,11,11-trimethyl-8-methylene-, [1R-(1R*,4E,9S*)]- (CAS) $$ l-Caryophyllene $$ (-)-Caryophyllene $$ Caryophyllene $$ .beta.-Caryop
100 41
80 69
93
60
79
40 55 91 133
27 105120
20 43
147
122 189204

20 60 100 140 180 220 260 300 340 380 420 460 500 540 580 620 660 700 740 780
Hit#:4 Entry:151916 Library:Wiley9.lib
SI:91 Formula:C15H24 CAS:87-44-5 MolWeight:204 RetIndex:0
CompName:trans-Caryophyllene $$ Bicyclo[7.2.0]undec-4-ene, 4,11,11-trimethyl-8-methylene-, [1R-(1R*,4E,9S*)]- (CAS) $$ l-Caryophyllene $$ (-)-Caryophyllene $$ Caryophyllene $$ .beta.-Caryop
100 41
80
69 91
60
133
40 55 105
27 120
20 43 147
189
122 162 204

20 60 100 140 180 220 260 300 340 380 420 460 500 540 580 620 660 700 740 780
Hit#:5 Entry:193962 Library:Wiley9.lib
SI:90 Formula:C15H26O CAS:4602-84-0 MolWeight:222 RetIndex:0
CompName:Farnesol $$ 2,6,10-Dodecatrien-1-ol, 3,7,11-trimethyl- (CAS) $$ Farnesyl alcohol $$ 3,7,11-trimethyl-2,6,10-dodecatrien-1-ol $$ Dihydrofarnesol $$ 3,7,11-Trimethyl-2,6,10-dodecatrieno
100 41
80
93
60 69 OH

40 55
79
27 91 107
20 43
123 147 189204

20 60 100 140 180 220 260 300 340 380 420 460 500 540 580 620 660 700 740 780
<< Target >>
Line#:16 R.Time:26.650(Scan#:4531) MassPeaks:411
RawMode:Averaged 26.645-26.655(4530-4532) BasePeak:93.05(2393)
BG Mode:Calc. from Peak Group 1 - Event 1 Scan
100 93
80
60 41

40 67 80
30 55
20 107 147
133 161 189 219 244260 284 306 330 357 391 414 438 455 486 516 542558 577 598 623639 666681 710 732 753 776

20 60 100 140 180 220 260 300 340 380 420 460 500 540 580 620 660 700 740 780
Hit#:1 Entry:151845 Library:Wiley9.lib
SI:89 Formula:C15H24 CAS:6753-98-6 MolWeight:204 RetIndex:0
CompName:.alpha.-Humulene (CAS) $$ 1,4,8-Cycloundecatriene, 2,6,6,9-tetramethyl-, (E,E,E)- (CAS) $$ 4,7,10-CYCLOUNDECATRIENE, 1,1,4,8-TETRAMETHYL-, ALL-CIS $$ Humulene $$ .alp
100 93
80
60 41

40 80
53
67
20 94107
29 136 161 204

20 60 100 140 180 220 260 300 340 380 420 460 500 540 580 620 660 700 740 780
Hit#:2 Entry:33629 Library:Wiley9.lib
SI:86 Formula:C10H16 CAS:502-99-8 MolWeight:136 RetIndex:0
CompName:Trans-Ocimene $$ 1,3,7-Octatriene, 3,7-dimethyl- (CAS) $$ 2,6-Dimethyl-1,5,7-octatriene $$ Ocimene $$ .alpha.-Ocimene (CAS) $$ 3,7-Dimethyl-1,3,7-octatriene $$ (3E)-3,7-Dimethyl-1
100 93
80
41
60 27

40 43 77
55
20 65 105 121
136

20 60 100 140 180 220 260 300 340 380 420 460 500 540 580 620 660 700 740 780
Hit#:3 Entry:152074 Library:Wiley9.lib
SI:86 Formula:C15H24 CAS:17066-67-0 MolWeight:204 RetIndex:0
CompName:.beta.-Selinene (CAS) $$ Naphthalene, decahydro-4a-methyl-1-methylene-7-(1-methylethenyl)-, [4aR-(4a.alpha.,7.alpha.,8a.beta.)]- (CAS) $$ Eudesma-4(14),11-diene (CAS) $$ .beta.-Eud
100 93
80
60
41
40 80
121
20 27 43 67 91 107
122 147 204

20 60 100 140 180 220 260 300 340 380 420 460 500 540 580 620 660 700 740 780
Hit#:4 Entry:33626 Library:Wiley9.lib
SI:85 Formula:C10H16 CAS:502-99-8 MolWeight:136 RetIndex:0
CompName:1,3,7-OCTATRIENE, 3,7-DIMETHYL- $$ 3,7-DIMETHYLOCTA-1,3,7-TRIENE $$ (3E)-3,7-DIMETHYL-1,3,7-OCTATRIENE # $$ (3E)-3,7-DIMETHYL-1,3,7-OCTATRIENE $$ (3E)-3
100 93
80
60
41
40 77
27
43 105 121
20 55
65 136
89 108

20 60 100 140 180 220 260 300 340 380 420 460 500 540 580 620 660 700 740 780
Hit#:5 Entry:33595 Library:Wiley9.lib
SI:85 Formula:C10H16 CAS:3338-55-4 MolWeight:136 RetIndex:0
CompName:1,3,6-Octatriene, 3,7-dimethyl-, (Z)- (CAS) $$ cis-3,7-Dimethyl-1,3,6-octatriene $$ .BETA. OCIMENE X $$ Z-Ocimene $$ .beta.-cis-Ocimene $$ cis-.beta.-Ocimene $$ Ocimene, cis-.beta
100 93
80
60
40 41
77
27
20 43 55 105 121
65 136
89 108

20 60 100 140 180 220 260 300 340 380 420 460 500 540 580 620 660 700 740 780
<< Target >>
Line#:17 R.Time:27.330(Scan#:4667) MassPeaks:450
RawMode:Averaged 27.325-27.335(4666-4668) BasePeak:161.00(7472)
BG Mode:Calc. from Peak Group 1 - Event 1 Scan
100 41 105 161
80 91
79
60 55
67
40 119
204
20 30 147
176 211 237 254 273 301 327 358 378 395411 445 468 487 515 543 560 583 603 631 655 681 700 725 750 772

10 50 90 130 170 210 250 290 330 370 410 450 490 530 570 610 650 690 730 770
Hit#:1 Entry:152381 Library:Wiley9.lib
SI:90 Formula:C15H24 CAS:23986-74-5 MolWeight:204 RetIndex:0
CompName:GERMACRENE-D $$ 1,6-CYCLODECADIENE, 1-METHYL-5-METHYLENE-8-(1-METHYLETHYL)-, [S-(E,E)]- $$ GERMACRA-1(10),4(15),5-TRIENE, (-)- $$ 8-ISOPROPYL-1-M
100 161
91 105
80
60
41 77 119
40
55 67 133
20 43 107 204
131 147 205

10 50 90 130 170 210 250 290 330 370 410 450 490 530 570 610 650 690 730 770
Hit#:2 Entry:152327 Library:Wiley9.lib
SI:89 Formula:C15H24 CAS:23986-74-5 MolWeight:204 RetIndex:0
CompName:Germacrene D $$ 1,6-Cyclodecadiene, 1-methyl-5-methylene-8-(1-methylethyl)-, [s-(E,E)]- (CAS) $$ 8-Isopropyl-1-methyl-5-methylene-1,6-cyclodecadiene $$ Germacra-1(10),4(15),5-trie
100 91 161
41
105
80
60 79
119
27
40 55 93
43 67 133
20 162 204

10 50 90 130 170 210 250 290 330 370 410 450 490 530 570 610 650 690 730 770
Hit#:3 Entry:152325 Library:Wiley9.lib
SI:89 Formula:C15H24 CAS:23986-74-5 MolWeight:204 RetIndex:0
CompName:Germacrene D $$ 1,6-Cyclodecadiene, 1-methyl-5-methylene-8-(1-methylethyl)-, [s-(E,E)]- (CAS) $$ 8-Isopropyl-1-methyl-5-methylene-1,6-cyclodecadiene $$ Germacra-1(10),4(15),5-trie
100 161
80 105
91
41 119
60
79
40 27 39
55 67 120
20 18 204
147

10 50 90 130 170 210 250 290 330 370 410 450 490 530 570 610 650 690 730 770
Hit#:4 Entry:152326 Library:Wiley9.lib
SI:88 Formula:C15H24 CAS:23986-74-5 MolWeight:204 RetIndex:0
CompName:Germacrene D $$ 1,6-Cyclodecadiene, 1-methyl-5-methylene-8-(1-methylethyl)-, [s-(E,E)]- (CAS) $$ 8-Isopropyl-1-methyl-5-methylene-1,6-cyclodecadiene $$ Germacra-1(10),4(15),5-trie
100 161
80 105
91
60 41
81
119
40 55
53 67 133
20 29 204
95 134

10 50 90 130 170 210 250 290 330 370 410 450 490 530 570 610 650 690 730 770
Hit#:5 Entry:152133 Library:Wiley9.lib
SI:86 Formula:C15H24 CAS:23515-88-0 MolWeight:204 RetIndex:0
CompName:.alpha.-Amorphene $$ .ALPHA. AMORPHENE $$ 6.alpha.-Cadina-4,9-diene, (-)- (CAS) $$ Naphthalene, 1,2,4a,5,6,8a-hexahydro-4,7-dimethyl-1-(1-methylethyl)-, [1S-(1.alpha.,4a.beta.,8
100 161
H
80 105
41 79 91
119
60
40 27 69 133
43 55 204 H
20 162

10 50 90 130 170 210 250 290 330 370 410 450 490 530 570 610 650 690 730 770
<< Target >>
Line#:18 R.Time:28.130(Scan#:4827) MassPeaks:403
RawMode:Averaged 28.125-28.135(4826-4828) BasePeak:161.00(7843)
BG Mode:Calc. from Peak Group 1 - Event 1 Scan
100 161
80 41
60 91 105
79
40 55 67 119 204
20
31 148 176 215 234 262 288 321 345 364 387 406 429 457 477 497 521 542 562 598 615 637652 669 687 707 731 755 783

10 50 90 130 170 210 250 290 330 370 410 450 490 530 570 610 650 690 730 770
Hit#:1 Entry:152037 Library:Wiley9.lib
SI:92 Formula:C15H24 CAS:39029-41-9 MolWeight:204 RetIndex:0
CompName:.gamma.-Cadinene (CAS) $$ Naphthalene, 1,2,3,4,4a,5,6,8a-octahydro-7-methyl-4-methylene-1-(1-methylethyl)-, (1.alpha.,4a.beta.,8a.alpha.)- (CAS) $$ .gamma. 2-cadinene $$ 1-Isopropyl
100 161
80 41

60 91 105
79
40 43 77 119
55 133 204
20 67
107 148 176 205

10 50 90 130 170 210 250 290 330 370 410 450 490 530 570 610 650 690 730 770
Hit#:2 Entry:152325 Library:Wiley9.lib
SI:91 Formula:C15H24 CAS:23986-74-5 MolWeight:204 RetIndex:0
CompName:Germacrene D $$ 1,6-Cyclodecadiene, 1-methyl-5-methylene-8-(1-methylethyl)-, [s-(E,E)]- (CAS) $$ 8-Isopropyl-1-methyl-5-methylene-1,6-cyclodecadiene $$ Germacra-1(10),4(15),5-trie
100 161
80 105
91
41 119
60
79
40 27 39
55 67 120
20 18 204
147

10 50 90 130 170 210 250 290 330 370 410 450 490 530 570 610 650 690 730 770
Hit#:3 Entry:152326 Library:Wiley9.lib
SI:91 Formula:C15H24 CAS:23986-74-5 MolWeight:204 RetIndex:0
CompName:Germacrene D $$ 1,6-Cyclodecadiene, 1-methyl-5-methylene-8-(1-methylethyl)-, [s-(E,E)]- (CAS) $$ 8-Isopropyl-1-methyl-5-methylene-1,6-cyclodecadiene $$ Germacra-1(10),4(15),5-trie
100 161
80 105
91
60 41
81
119
40 55
53 67 133
20 29 204
95 134

10 50 90 130 170 210 250 290 330 370 410 450 490 530 570 610 650 690 730 770
Hit#:4 Entry:152125 Library:Wiley9.lib
SI:90 Formula:C15H24 CAS:30021-74-0 MolWeight:204 RetIndex:0
CompName:NAPHTHALENE, 1,2,3,4,4A,5,6,8A-OCTAHYDRO-7-METHYL-4-METHYLENE-1-(1-METHYLETHYL)-, (1.ALPHA.,4A.ALPHA.,8A.ALPHA.)- $$ NAPHTHALENE, 1,2,3,4,4A.BET
100 161
80
60 93
119
40 41 79 91
204
55 133
20 27 43
69 162
122 148 189

10 50 90 130 170 210 250 290 330 370 410 450 490 530 570 610 650 690 730 770
Hit#:5 Entry:152381 Library:Wiley9.lib
SI:89 Formula:C15H24 CAS:23986-74-5 MolWeight:204 RetIndex:0
CompName:GERMACRENE-D $$ 1,6-CYCLODECADIENE, 1-METHYL-5-METHYLENE-8-(1-METHYLETHYL)-, [S-(E,E)]- $$ GERMACRA-1(10),4(15),5-TRIENE, (-)- $$ 8-ISOPROPYL-1-M
100 161
91 105
80
60
41 77 119
40
55 67 133
20 43 107 204
131 147 205

10 50 90 130 170 210 250 290 330 370 410 450 490 530 570 610 650 690 730 770
<< Target >>
Line#:19 R.Time:28.345(Scan#:4870) MassPeaks:450
RawMode:Averaged 28.340-28.350(4869-4871) BasePeak:161.00(6904)
BG Mode:Calc. from Peak Group 1 - Event 1 Scan
100 161
80 105
41
60 91 119 204
81
40 134
55
69 189
20 32 147 176 210225 250 275 303 332 355 372 401416 445 465 485 510 533 551566 590606 625 652 680 701 723 752 770 788

20 60 100 140 180 220 260 300 340 380 420 460 500 540 580 620 660 700 740 780
Hit#:1 Entry:152050 Library:Wiley9.lib
SI:92 Formula:C15H24 CAS:483-76-1 MolWeight:204 RetIndex:0
CompName:.delta.-Cadinene (CAS) $$ Naphthalene, 1,2,3,5,6,8a-hexahydro-4,7-dimethyl-1-(1-methylethyl)-, (1S-cis)- (CAS) $$ (+)-.delta.-Cadinene $$ Cadina-1(10),4-diene (CAS) $$ .delta.-Cadine
100 161
80
105119
60 134
204
41 91
81
40
55 77 H
189
20 43 69 106 131 147 205

20 60 100 140 180 220 260 300 340 380 420 460 500 540 580 620 660 700 740 780
Hit#:2 Entry:152490 Library:Wiley9.lib
SI:89 Formula:C15H24 CAS:0-00-0 MolWeight:204 RetIndex:0
CompName:(-)-ISOLEDENE
100 105 161
80
91
60 41 119

40 133
204
55 77
147 189
20 43 67 107
131 205
175

20 60 100 140 180 220 260 300 340 380 420 460 500 540 580 620 660 700 740 780
Hit#:3 Entry:152217 Library:Wiley9.lib
SI:88 Formula:C15H24 CAS:489-39-4 MolWeight:204 RetIndex:0
CompName:1H-CYCLOPROP[E]AZULENE, DECAHYDRO-1,1,7-TRIMETHYL-4-METHYLENE-, [1AR-(1A.ALPHA.,4A.ALPHA.,7.ALPHA.,7A.BETA.,7B.ALPHA.)]- $$ AROMADENDRENE
100 105 161
H
80 41

60 91
119
204
40 27 55 133 H
77 93
43 67 147162 189
20 131

20 60 100 140 180 220 260 300 340 380 420 460 500 540 580 620 660 700 740 780
Hit#:4 Entry:152048 Library:Wiley9.lib
SI:88 Formula:C15H24 CAS:483-76-1 MolWeight:204 RetIndex:0
CompName:.delta.-Cadinene (CAS) $$ Naphthalene, 1,2,3,5,6,8a-hexahydro-4,7-dimethyl-1-(1-methylethyl)-, (1S-cis)- (CAS) $$ (+)-.delta.-Cadinene $$ Cadina-1(10),4-diene (CAS) $$ .delta.-Cadine
100 161
80 119
105
134
60 91
204
40
41 H
77
20 106 128 189
55 69 145
43 205

20 60 100 140 180 220 260 300 340 380 420 460 500 540 580 620 660 700 740 780
Hit#:5 Entry:152049 Library:Wiley9.lib
SI:88 Formula:C15H24 CAS:483-76-1 MolWeight:204 RetIndex:0
CompName:.delta.-Cadinene (CAS) $$ Naphthalene, 1,2,3,5,6,8a-hexahydro-4,7-dimethyl-1-(1-methylethyl)-, (1S-cis)- (CAS) $$ (+)-.delta.-Cadinene $$ Cadina-1(10),4-diene (CAS) $$ .delta.-Cadine
100 134
204
80 105

60 41
8191
40 162
55 93 189 H
20 27 43 69
131 147

20 60 100 140 180 220 260 300 340 380 420 460 500 540 580 620 660 700 740 780
<< Target >>
Line#:20 R.Time:28.825(Scan#:4966) MassPeaks:431
RawMode:Averaged 28.820-28.830(4965-4967) BasePeak:59.00(17202)
BG Mode:Calc. from Peak Group 1 - Event 1 Scan
100 59
80
60 41
93
40 79 107 161
20 121
30 147 175 204 220 243 261 282297313 334 352 369 386 403 426 448 485 505 526 543 564 587 606622638 661 693 713 741757 778

20 60 100 140 180 220 260 300 340 380 420 460 500 540 580 620 660 700 740 780
Hit#:1 Entry:194008 Library:Wiley9.lib
SI:90 Formula:C15H26O CAS:639-99-6 MolWeight:222 RetIndex:0
CompName:Elemol $$ Cyclohexanemethanol, 4-ethenyl-.alpha.,.alpha.,4-trimethyl-3-(1-methylethenyl)-, [1R-(1.alpha.,3.alpha.,4.beta.)]- (CAS) $$ o-Menth-8-ene-4-methanol, .alpha.,.alpha.-dimethyl
100 59
80
28
60 93 OH
41
40 43 81 107 161
67 135
20 91 123 149162 189204

20 60 100 140 180 220 260 300 340 380 420 460 500 540 580 620 660 700 740 780
Hit#:2 Entry:194015 Library:Wiley9.lib
SI:89 Formula:C15H26O CAS:21657-90-9 MolWeight:222 RetIndex:0
CompName:Hedycaryol $$ 3,7-Cyclodecadiene-1-methanol, .alpha.,.alpha.,4,8-tetramethyl-, [s-( $$ 3,7-Cyclodecadiene-1-methanol, .alpha.,.alpha.,4,8-tetramethyl-, [s-(Z,Z)] $$ 2-(4,8-Dimethyl-3,7-cy
100 59
80
93
60
OH
40 41 81 161
107
67 135
20 31 82 123 149162 189204

20 60 100 140 180 220 260 300 340 380 420 460 500 540 580 620 660 700 740 780
Hit#:3 Entry:194017 Library:Wiley9.lib
SI:89 Formula:C15H26O CAS:21657-90-9 MolWeight:222 RetIndex:0
CompName:Hedycaryol $$ 3,7-Cyclodecadiene-1-methanol, .alpha.,.alpha.,4,8-tetramethyl-, [s-( $$ 3,7-Cyclodecadiene-1-methanol, .alpha.,.alpha.,4,8-tetramethyl-, [s-(Z,Z)] $$ 2-(4,8-Dimethyl-3,7-cy
100 59
80
93
60
OH
40 41 81 161
107
67 135
20 31 91 123 149162 189
204

20 60 100 140 180 220 260 300 340 380 420 460 500 540 580 620 660 700 740 780
Hit#:4 Entry:194011 Library:Wiley9.lib
SI:88 Formula:C15H26O CAS:639-99-6 MolWeight:222 RetIndex:0
CompName:Elemol $$ Cyclohexanemethanol, 4-ethenyl-.alpha.,.alpha.,4-trimethyl-3-(1-methylethenyl)-, [1R-(1.alpha.,3.alpha.,4.beta.)]- (CAS) $$ o-Menth-8-ene-4-methanol, .alpha.,.alpha.-dimethyl
100 59
80 43
93
60 OH
67 107 161
40 79
53 121
20 108 133
149162
189
204

20 60 100 140 180 220 260 300 340 380 420 460 500 540 580 620 660 700 740 780
Hit#:5 Entry:194006 Library:Wiley9.lib
SI:88 Formula:C15H26O CAS:639-99-6 MolWeight:222 RetIndex:0
CompName:Elemol $$ Cyclohexanemethanol, 4-ethenyl-.alpha.,.alpha.,4-trimethyl-3-(1-methylethenyl)-, [1R-(1.alpha.,3.alpha.,4.beta.)]- (CAS) $$ o-Menth-8-ene-4-methanol, .alpha.,.alpha.-dimethyl
100 59
80
93
60 OH
41 81 161
40 107
67 135
20 29 91 123 149163
189
204

20 60 100 140 180 220 260 300 340 380 420 460 500 540 580 620 660 700 740 780
<< Target >>
Line#:21 R.Time:28.960(Scan#:4993) MassPeaks:359
RawMode:Averaged 28.955-28.965(4992-4994) BasePeak:69.00(4728)
BG Mode:Calc. from Peak Group 1 - Event 1 Scan
100 69
41
80
60
43
40 71
93
20
31 107 136 161 194 211 227 248 273 290 309 327 352 369 397413 438 459 485 516 535 569584 607 642 666 696 719 736 755 781

20 60 100 140 180 220 260 300 340 380 420 460 500 540 580 620 660 700 740 780
Hit#:1 Entry:198901 Library:Wiley9.lib
SI:91 Formula:C14H24O2 CAS:2345-26-8 MolWeight:224 RetIndex:0
CompName:Propanoic acid, 2-methyl-, 3,7-dimethyl-2,6-octadienyl ester, (E)- (CAS) $$ Geranyl isobutyrate $$ GERANYL 2-METHYLPROPANOATE $$ Isobutyric acid, (E)-3,7-dimethyl-2,6-octadi
100 69
80
41
60 93 O

40 71
O

20 27 53 80 121136
85 107 154

20 60 100 140 180 220 260 300 340 380 420 460 500 540 580 620 660 700 740 780
Hit#:2 Entry:134290 Library:Wiley9.lib
SI:90 Formula:C12H20O2 CAS:141-12-8 MolWeight:196 RetIndex:0
CompName:2,6-OCTADIEN-1-OL, 3,7-DIMETHYL-, ACETATE, (Z)- $$ (2Z)-3,7-DIMETHYL-2,6-OCTADIENYL ACETATE # $$ (2Z)-3,7-DIMETHYL-2,6-OCTADIENYL ACETATE $$ (2Z)-3,7-D
100 69
80 41
O
60
43 93
40 O

20 80 121136
27 53 77 91 105
154

20 60 100 140 180 220 260 300 340 380 420 460 500 540 580 620 660 700 740 780
Hit#:3 Entry:134502 Library:Wiley9.lib
SI:89 Formula:C12H20O2 CAS:141-12-8 MolWeight:196 RetIndex:0
CompName:NERYL ACETATE $$ NERYLACETAT $$ 2,6-OCTADIEN-1-OL, 3,7-DIMETHYL-, ACETATE, (Z)- $$ (2Z)-3,7-DIMETHYL-2,6-OCTADIENYL ACETATE # $$ (2Z)-3,7-DIMETHYL-2
100 69
80 41

60 43
93 O
40
27 80
20 29 53
121 O
70 84 107 136
56 154

20 60 100 140 180 220 260 300 340 380 420 460 500 540 580 620 660 700 740 780
Hit#:4 Entry:134304 Library:Wiley9.lib
SI:89 Formula:C12H20O2 CAS:105-87-3 MolWeight:196 RetIndex:0
CompName:Geranyl acetate $$ 2,6-Octadien-1-ol, 3,7-dimethyl-, acetate, (E)- (CAS) $$ Geraniol acetate (CAS) $$ Bay pine (oyster) oil $$ Acetic acid geraniol ester $$ trans-3,7-Dimethyl-2,6-octadien
100 69
41
80
O
60
40 O
93
20 27 53 121
57 77 105 127 154

20 60 100 140 180 220 260 300 340 380 420 460 500 540 580 620 660 700 740 780
Hit#:5 Entry:134293 Library:Wiley9.lib
SI:89 Formula:C12H20O2 CAS:141-12-8 MolWeight:196 RetIndex:0
CompName:Neryl acetate $$ 2,6-Octadien-1-ol, 3,7-dimethyl-, acetate, (Z)- (CAS) $$ Nerol acetate (CAS) $$ Linalyl, neryl, geranyl acetates, mixture $$ (2Z)-3,7-Dimethyl-2,6-octadienyl acetate $$ (2
100 69
80 41
O
60 43

40 93 O

20 27 53
80
121
7785 105 127 154

20 60 100 140 180 220 260 300 340 380 420 460 500 540 580 620 660 700 740 780
<< Target >>
Line#:22 R.Time:29.575(Scan#:5116) MassPeaks:419
RawMode:Averaged 29.570-29.580(5115-5117) BasePeak:81.05(6220)
BG Mode:Calc. from Peak Group 1 - Event 1 Scan
100 81
80 43
60 41
105 161
40 67 91
20 119 204
31 147 175 222 244 265 288 319 338 360376 405 422 456 473 498 516532 553569 594 615 641 668 695 726 747 766 783

10 50 90 130 170 210 250 290 330 370 410 450 490 530 570 610 650 690 730 770
Hit#:1 Entry:194286 Library:Wiley9.lib
SI:84 Formula:C15H26O CAS:74841-87-5 MolWeight:222 RetIndex:0
CompName:GERMACRENE D-4-OL
100 81
43
80
60
40 105
67 79 93 123 161
20 53 109 204
133 189 207 OH

10 50 90 130 170 210 250 290 330 370 410 450 490 530 570 610 650 690 730 770
Hit#:2 Entry:194115 Library:Wiley9.lib
SI:81 Formula:C15H26O CAS:19435-97-3 MolWeight:222 RetIndex:0
CompName:Torreyol $$ 1-Naphthalenol, 1,2,3,4,4a,7,8,8a-octahydro-1,6-dimethyl-4-(1-methylethyl)-, [1R-(1.alpha.,4.beta.,4a.beta.,8a.beta.)]- (CAS) $$ 5.BETA.-ISOPROPYL-2.BETA.,8-DIMETHY
100 43 161
80
60 119 HO
105
40 79 95 204
55
69
20 53 109 133
162
189

10 50 90 130 170 210 250 290 330 370 410 450 490 530 570 610 650 690 730 770
Hit#:3 Entry:152512 Library:Wiley9.lib
SI:81 Formula:C15H24 CAS:0-00-0 MolWeight:204 RetIndex:0
CompName:Bicyclo[5.2.0]nonane, 4-methylene-2,8,8-trimethyl-2-vinyl- $$ BICYCLO[5.2.0]NONAN, 4-METHYLEN-2,8,8-TRIMETHYL-2-VINYL- (ISOCARYOPHYLLEN-"V1") $$ 2,8,8-Trimeth
100 81
80
93
60
41
107
40
39 55 67 119
20 27 65
95
147
176

10 50 90 130 170 210 250 290 330 370 410 450 490 530 570 610 650 690 730 770
Hit#:4 Entry:194123 Library:Wiley9.lib
SI:80 Formula:C15H26O CAS:36564-42-8 MolWeight:222 RetIndex:0
CompName:.delta.-Cadinol $$ 1-Naphthalenol, 1,2,3,4,4a,7,8,8a-octahydro-1,6-dimethyl-4-(1-methylethyl)-, [1S-(1.alpha.,4.alpha.,4a.beta.,8a.beta.)]- (CAS) $$ Amorphan-3-en-9-ol $$ DELTA-CADIN
100 161
80
43
60 HO
41 105
40 79
95 204
55 69 91
20 27 162
122 147 189

10 50 90 130 170 210 250 290 330 370 410 450 490 530 570 610 650 690 730 770
Hit#:5 Entry:194112 Library:Wiley9.lib
SI:80 Formula:C15H26O CAS:19435-97-3 MolWeight:222 RetIndex:0
CompName:Torreyol $$ 1-Naphthalenol, 1,2,3,4,4a,7,8,8a-octahydro-1,6-dimethyl-4-(1-methylethyl)-, [1R-(1.alpha.,4.beta.,4a.beta.,8a.beta.)]- (CAS) $$ 5.BETA.-ISOPROPYL-2.BETA.,8-DIMETHY
100 43 161
80
60 119 HO
41 95
40 81 204
55 69
91
20 29 189
18 123 147

10 50 90 130 170 210 250 290 330 370 410 450 490 530 570 610 650 690 730 770

Method

[Comment]

===== Analytical Line 1 =====

[AOC-20i+s]
# of Rinses with Presolvent :2
# of Rinses with Solvent(post) :10
# of Rinses with Sample :2
Plunger Speed(Suction) :High
Viscosity Comp. Time :0.2 sec
Plunger Speed(Injection) :High
Syringe Insertion Speed :High
Injection Mode :Normal
Pumping Times :5
Inj. Port Dwell Time :0.3 sec
Terminal Air Gap :No
Plunger Washing Speed :High
Washing Volume :8uL
Syringe Suction Position :0.0 mm
Syringe Injection Position :0.0 mm
Solvent Selection :only A

[GC-2010]
Column Oven Temp. :40.0 °C
Injection Temp. :250.00 °C
Injection Mode :Split
Flow Control Mode :Pressure
Pressure :24.9 kPa
Total Flow :31.7 mL/min
Column Flow :0.70 mL/min
Linear Velocity :30.2 cm/sec
Purge Flow :3.0 mL/min
Split Ratio :40.0
High Pressure Injection :OFF
Carrier Gas Saver :OFF
Splitter Hold :OFF
Oven Temp. Program
Rate Temperature(°C) Hold Time(min)
- 40.0 3.00
5.00 250.0 5.00

< Ready Check Heat Unit >

Column Oven : Yes
SPL1 : Yes
MS : Yes
< Ready Check Detector(FTD/BID) >
< Ready Check Baseline Drift >
< Ready Check Injection Flow >
SPL1 Carrier : Yes
SPL1 Purge : Yes
< Ready Check APC Flow >
< Ready Check Detector APC Flow >
External Wait :No
Equilibrium Time :3.0 min

[GC Program]

[GCMS-QP2010 Ultra]
IonSourceTemp :200.00 °C
Interface Temp. :250.00 °C
Solvent Cut Time :0.50 min
Detector Gain Mode :Relative to the Tuning Result
Detector Gain :1.04 kV +0.00 kV
Threshold :0

[MS Table]
--Group 1 - Event 1--
Start Time :4.00min
End Time :50.00min
ACQ Mode :Scan
Event Time :0.30sec
Scan Speed :3333
Start m/z :30.00
End m/z :800.00

Sample Inlet Unit :GC

[MS Program]
Use MS Program :OFF