Spektraris NMR
Diepoxi-xeniaphyllenol-A
Common Name: Diepoxi-xeniaphyllenol-A
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C20H32O3/c1-12-6-7-16-20(5,22-16)9-8-14-13(12)10-19(14,4)11-15(21)17-18(2,3)23-17/h13-17,21H,1,6-11H2,2-5H3/t13-,14+,15?,16-,17?,19-,20+/m0/s1
InChIKey: InChIKey=HSGBINLKOKRGCU-GRPSCZQZSA-N
Formula: C20H32O3
Molecular Weight: 320.467037
Exact Mass: 320.235145
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Groweiss, A., Kashman, Y. Tetrahedron (1983) 39, 3385
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Xeniaphyllanes; 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 (CH) | 49.4 |
| 2 (CH2) | 27.8 |
| 3 (CH2) | 39.1 |
| 4 (C) | 59.9 |
| 5 (CH) | 63.9 |
| 6 (CH2) | 30.3 |
| 7 (CH2) | 29.4 |
| 8 (C) | 151.7 |
| 9 (CH) | 49.1 |
| 10 (CH2) | 38.9 |
| 11 (C) | 35.9 |
| 12 (CH2) | 47.4 |
| 13 (CH) | 68.3 |
| 14 (CH) | 68 |
| 15 (C) | 59.9 |
| 16 (CH3) | 24.9 |
| 17 (CH3) | 19.2 |
| 18 (CH3) | 19.5 |
| 19 (CH2) | 113.1 |
| 20 (CH3) | 17.1 |
