2-[(1R)-1,2,3,3abeta,4,5,6,7-Octahydro-1alpha,4alpha-dimethylazulen-7beta-yl]-1,2-propanediol

2-[(1R)-1,2,3,3abeta,4,5,6,7-Octahydro-1alpha,4alpha-dimethylazulen-7beta-yl]-1,2-propanediol

Common Name: 2-[(1R)-1,2,3,3abeta,4,5,6,7-Octahydro-1alpha,4alpha-dimethylazulen-7beta-yl]-1,2-propanediol

Synonyms: 2-[(1R)-1,2,3,3abeta,4,5,6,7-Octahydro-1alpha,4alpha-dimethylazulen-7beta-yl]-1,2-propanediol

CAS Registry Number:

InChI: InChI=1S/C15H26O2/c1-10-4-6-12(15(3,17)9-16)8-14-11(2)5-7-13(10)14/h8,10-13,16-17H,4-7,9H2,1-3H3/t10-,11-,12-,13-,15?/m1/s1

InChIKey: InChIKey=HPIKFWIDHCWTLO-DVKSKCSOSA-N

Formula: C15H26O2

Molecular Weight: 238.366308

Exact Mass: 238.19328

NMR Solvent: CDCl3

MHz:

Calibration:

NMR references: 13C - Miyazawa, M., Honjo, Y., Kameoka, H. Phytochemistry (1998) 49, 1283-5

Species:

Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Guaianes; 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) 46
2 (CH2) 29.7
3 (CH2) 33.51
4 (CH) 38.13
5 (C) 134.1
6 (CH) 109.69
7 (CH) 48.57
8 (CH2) 25.3
9 (CH2) 32.93
10 (CH) 33.76
11 (C) 80.5
12 (CH3) 21.15
13 (CH2) 78.8
14 (CH3) 14.57
15 (CH3) 20.27