Spektraris NMR
12,13-dehydrogeranylgeraniol
Common Name: 12,13-dehydrogeranylgeraniol
Synonyms: 12,13-dehydrogeranylgeraniol
CAS Registry Number:
InChI: InChI=1S/C20H32O/c1-17(2)9-6-10-18(3)11-7-12-19(4)13-8-14-20(5)15-16-21/h6,9-11,13,15,21H,7-8,12,14,16H2,1-5H3/b10-6+,18-11+,19-13+,20-15+
InChIKey: InChIKey=OTYIYOOKHMFXBC-UBZGHHIISA-N
Formula: C20H32O1
Molecular Weight: 288.468227
Exact Mass: 288.245316
NMR Solvent: C6D6
MHz:
Calibration:
NMR references: 13C - Rajbhandari, I., Takamatsu, S., Nagle, D.G. J Nat Prod (2001) 64, 693-5
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Phytanes; 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 (CH2) | 59.73 |
| 2 (CH) | 125.3 |
| 3 (C) | 138.4 |
| 4 (CH2) | 40.18 |
| 5 (CH2) | 27.08 |
| 6 (CH) | 125.15 |
| 7 (C) | 135.3 |
| 8 (CH2) | 40.18 |
| 9 (CH2) | 27.8 |
| 10 (CH) | 132.2 |
| 11 (C) | 134.97 |
| 12 (CH) | 136.18 |
| 13 (CH) | 123.74 |
| 14 (CH) | 127.09 |
| 15 (C) | 134.07 |
| 16 (CH3) | 26.5 |
| 17 (CH3) | 16.55 |
| 18 (CH3) | 16.42 |
| 19 (CH3) | 12.99 |
| 20 (CH3) | 18.7 |
