Spektraris NMR
(4S)-3b,12-Dihydroxycadin-10(15)-ene
Common Name: (4S)-3b,12-Dihydroxycadin-10(15)-ene
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C15H26O2/c1-9-5-6-13(15(3,4)17)12-7-10(2)14(16)8-11(9)12/h10-14,16-17H,1,5-8H2,2-4H3/t10-,11-,12+,13+,14-/m0/s1
InChIKey: InChIKey=QRBOTGDTNVITHK-QNSTZXKLSA-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) | 45.9 |
| 2 (CH2) | 38.3 |
| 3 (CH) | 75.9 |
| 4 (CH) | 40 |
| 5 (CH2) | 39.9 |
| 6 (CH) | 45 |
| 7 (CH) | 53 |
| 8 (CH2) | 31 |
| 9 (CH2) | 36.3 |
| 10 (C) | 151.7 |
| 11 (C) | 74.2 |
| 12 (CH3) | 24.2 |
| 13 (CH3) | 32 |
| 14 (CH3) | 18.5 |
| 15 (CH2) | 104.2 |
