Spektraris NMR
Wallichanol A
Common Name: Wallichanol A
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C20H32O2/c1-17(2)14-4-7-19-9-12-10-20(22,11-19)13(12)8-15(19)18(14,3)6-5-16(17)21/h12-16,21-22H,4-11H2,1-3H3/t12?,13-,14-,15+,16-,18-,19+,20+/m1/s1
InChIKey: InChIKey=PCMTWJSNRSTKDV-AGSKUBJVSA-N
Formula: C20H32O2
Molecular Weight: 304.467632
Exact Mass: 304.24023
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Pan, L., Zhou, P., Zhang, X., Peng, S., Ding, L., Qiu, S.X. Org Lett (2006) 8, 2775_78
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Wallichanes; 13 C Spectrum from Naproc 13: José Luis López-Pérez, Roberto Therón, Esther del Olmo, David Díaz: NAPROC-13: a database for the dereplication of natural product mixtures in bioassay-guided protocols. Bioinformatics 23(23):3256-3257 (2007)
Carbon NMR Peaks
| Position | PPM |
|---|---|
| 1 (CH2) | 37.8 |
| 2 (CH2) | 26.8 |
| 3 (CH) | 79.1 |
| 4 (C) | 38.7 |
| 5 (CH) | 55.4 |
| 6 (CH2) | 18.8 |
| 7 (CH2) | 40.7 |
| 8 (C) | 35.9 |
| 9 (CH) | 53.7 |
| 10 (C) | 38 |
| 11 (CH2) | 19.5 |
| 12 (CH) | 43.1 |
| 13 (CH) | 25.8 |
| 14 (CH2) | 33.8 |
| 15 (CH2) | 53.5 |
| 16 (C) | 73.4 |
| 17 (CH2) | 47.6 |
| 18 (CH3) | 27.9 |
| 19 (CH3) | 15.4 |
| 20 (CH3) | 15.1 |
