Spektraris NMR
Xenotorin C
Common Name: Xenotorin C
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C15H24O/c1-10(2)12-7-8-15(4,16)14-6-5-11(3)9-13(12)14/h7-8,11-14,16H,1,5-6,9H2,2-4H3/t11-,12-,13-,14+,15-/m0/s1
InChIKey: InChIKey=NQKWUNQUPNPCCJ-LXFSFDBISA-N
Formula: C15H24O1
Molecular Weight: 220.351021
Exact Mass: 220.182715
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Duh, C.Y., Chien, S.C., Song, P.Y., Wang, S.K., El-Gamal, A.A., Dai, C.F. J Nat Prod (2002) 65, 1853-6
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) | 47.6 |
| 2 (CH2) | 18.9 |
| 3 (CH2) | 31.4 |
| 4 (CH) | 27.2 |
| 5 (CH2) | 37 |
| 6 (CH) | 29.4 |
| 7 (CH) | 52.7 |
| 8 (CH) | 132.6 |
| 9 (CH) | 134.6 |
| 10 (C) | 68.6 |
| 11 (C) | 146.6 |
| 12 (CH2) | 112.8 |
| 13 (CH3) | 18.9 |
| 14 (CH3) | 17.6 |
| 15 (CH3) | 27.3 |
