ChemNMR 13C Estimation

17.4
1.10
O

H
55.8

Estimation quality is indicated by color: good, medium, rough

60 50 40 30 20 10 0
PPM

Protocol of the C-13 NMR Prediction:

Node Shift Base + Inc. Comment (ppm rel. to TMS)

CH2 55.8 -2.3 aliphatic

9.1 1 alpha -C
49.0 1 alpha -O
CH3 17.4 -2.3 aliphatic
9.1 1 alpha -C
10.1 1 beta -O
0.5 general corrections