Spektraris NMR
(4S)-3a,14-Dihydroxycadin-10(15)-ene
Common Name: (4S)-3a,14-Dihydroxycadin-10(15)-ene
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C15H26O2/c1-9-4-5-12(11(3)8-16)14-6-10(2)15(17)7-13(9)14/h10-17H,1,4-8H2,2-3H3/t10-,11+,12-,13-,14-,15+/m0/s1
InChIKey: InChIKey=YULOSMAIJZMXGD-JLZCTACVSA-N
Formula: C15H26O2
Molecular Weight: 238.366308
Exact Mass: 238.19328
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Collins, D.O., Ruddock, P.L., Chiverton de Grasse, J., Reynolds, W.F., Reese, P.B. Phytochemistry (2002) 59, 479-88
Species:
Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Cadinanes; 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) | 45 |
| 2 (CH2) | 36.5 |
| 3 (CH) | 70.4 |
| 4 (CH) | 35.9 |
| 5 (CH2) | 31.9 |
| 6 (CH) | 39.1 |
| 7 (CH) | 42.8 |
| 8 (CH2) | 26.8 |
| 9 (CH2) | 36.4 |
| 10 (C) | 152.8 |
| 11 (CH) | 34.6 |
| 12 (CH3) | 10.2 |
| 13 (CH2) | 67.4 |
| 14 (CH3) | 18.6 |
| 15 (CH2) | 103.8 |
