Spektraris NMR
(4S)-3alpha-Hydroxycadin-10(15)-ene
Common Name: (4S)-3alpha-Hydroxycadin-10(15)-ene
Synonyms: (4S)-3alpha-Hydroxycadin-10(15)-ene
CAS Registry Number:
InChI: InChI=1S/C15H26O/c1-9(2)12-6-5-10(3)13-8-15(16)11(4)7-14(12)13/h9,11-16H,3,5-8H2,1-2,4H3/t11-,12-,13-,14-,15+/m0/s1
InChIKey: InChIKey=HMNKVQOCUYFAGU-YYFQZIEXSA-N
Formula: C15H26O1
Molecular Weight: 222.366903
Exact Mass: 222.198365
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Buchanan, G.O., Williams, L.A., Reese, P.B. Phytochemistry (2000) 54, 39-45
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) | 45.5 |
| 2 (CH2) | 36.7 |
| 3 (CH) | 70.4 |
| 4 (CH) | 35.8 |
| 5 (CH2) | 31.9 |
| 6 (CH) | 39 |
| 7 (CH) | 47.8 |
| 8 (CH2) | 26.3 |
| 9 (CH2) | 36.4 |
| 10 (C) | 153.3 |
| 11 (CH) | 26 |
| 12 (CH3) | 21.6 |
| 13 (CH3) | 15 |
| 14 (CH3) | 18.6 |
| 15 (CH2) | 103.4 |
