Common Name: 1,3(8)-Ochtodien-5,6(S*)-diol
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C10H16O2/c1-4-7-5-8(11)9(12)10(2,3)6-7/h4,6,8-9,11-12H,1,5H2,2-3H3/t8?,9-/m1/s1
InChIKey: InChIKey=LGRVNVACYBVGTJ-YGPZHTELSA-N
Formula: C10H16O2
Molecular Weight: 168.233221
Exact Mass: 168.11503
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Paul, V.J., McConnell, O.J., Fenical, W. J Org Chem (1980) 45, 3401-7
Species:
Notes: Family : Terpenoids, Type : Monoterpenoids, Group : Ochtodanes; 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)
Position | PPM |
---|---|
1 (CH2) | 112.6 |
2 (CH) | 128.4 |
3 (C) | 136.9 |
4 (CH2) | 33.6 |
5 (CH) | 68.2 |
6 (CH) | 75.6 |
7 (C) | 34.9 |
8 (CH) | 139.7 |
9 (CH3) | 27.2 |
10 (CH3) | 24.8 |