1,4-Dimethyl-7alpha,8alpha-isopropylidene-3,5,6,7,8,8aalpha-hexahydroazulene

1,4-Dimethyl-7alpha,8alpha-isopropylidene-3,5,6,7,8,8aalpha-hexahydroazulene

Common Name: 1,4-Dimethyl-7alpha,8alpha-isopropylidene-3,5,6,7,8,8aalpha-hexahydroazulene

Synonyms: 1,4-Dimethyl-7alpha,8alpha-isopropylidene-3,5,6,7,8,8aalpha-hexahydroazulene

CAS Registry Number:

InChI: InChI=1S/C15H22/c1-9-6-8-12-14(15(12,3)4)13-10(2)5-7-11(9)13/h5,12-14H,6-8H2,1-4H3/t12-,13-,14-/m0/s1

InChIKey: InChIKey=ABTDAARSCHTOMI-IHRRRGAJSA-N

Formula: C15H22

Molecular Weight: 202.335735

Exact Mass: 202.172151

NMR Solvent: CDCl3

MHz:

Calibration:

NMR references: 13C - Adio, A.M., Konig, W.A. Phytochemistry (2005) 66, 599-609

Species:

Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Aromadendranes; 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) 136.9
2 (CH2) 39.1
3 (CH) 121.8
4 (C) 143.2
5 (CH) 46.8
6 (CH) 35.1
7 (CH) 26.7
8 (CH2) 23.1
9 (CH2) 37.1
10 (C) 125.6
11 (C) 19.2
12 (CH3) 16.2
13 (CH3) 29
14 (CH3) 22
15 (CH3) 15.5