Spektraris NMR
(8S)-8-Hydroxypatchoulol
Common Name: (8S)-8-Hydroxypatchoulol
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C15H26O2/c1-9-5-6-15(17)13(2,3)11-7-10(9)14(15,4)8-12(11)16/h9-12,16-17H,5-8H2,1-4H3/t9-,10?,11?,12-,14-,15+/m0/s1
InChIKey: InChIKey=WKGPQOAMUAIBRO-HCTAKKQDSA-N
Formula: C15H26O2
Molecular Weight: 238.366308
Exact Mass: 238.19328
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Aleu, J., Hanson, J.R., Galan, R.H., Collado, I.G. J Nat Prod (1999) 62, 437-40
Species:
Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Patchoulanes; 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 (C) | 74.4 |
| 2 (CH2) | 32.8 |
| 3 (CH2) | 28.6 |
| 4 (CH) | 28 |
| 5 (CH) | 42.8 |
| 6 (CH2) | 15.5 |
| 7 (CH) | 45.6 |
| 8 (CH) | 66.1 |
| 9 (CH2) | 40.7 |
| 10 (C) | 38.8 |
| 11 (C) | 40 |
| 12 (CH3) | 18.4 |
| 13 (CH3) | 20.2 |
| 14 (CH3) | 26.1 |
| 15 (CH3) | 24.6 |
