Spektraris NMR
(5R)-5-Hydroxypatchoulol
Common Name: (5R)-5-Hydroxypatchoulol
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C15H26O2/c1-10-5-8-15(17)12(2,3)11-6-7-13(15,4)14(10,16)9-11/h10-11,16-17H,5-9H2,1-4H3/t10-,11?,13-,14+,15+/m0/s1
InChIKey: InChIKey=IPUFFAVJUSCNSW-VHOIETNVSA-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) | 75.6 |
| 2 (CH2) | 31.7 |
| 3 (CH2) | 22.8 |
| 4 (CH) | 34.6 |
| 5 (C) | 76.4 |
| 6 (CH2) | 34.5 |
| 7 (CH) | 39 |
| 8 (CH2) | 23.5 |
| 9 (CH2) | 29.6 |
| 10 (C) | 43.4 |
| 11 (C) | 39.4 |
| 12 (CH3) | 14 |
| 13 (CH3) | 14.8 |
| 14 (CH3) | 27 |
| 15 (CH3) | 24.3 |
