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2-((3S,5R,8S)-3,8-dimethyl-1,2,3,4,5,6,7,8-octahydroazulen-5-yl)propan-2-ol

View entire compound with spectra: 1 NMR, and 4 MS (GC)

2-((3S,5R,8S)-3,8-dimethyl-1,2,3,4,5,6,7,8-octahydroazulen-5-yl)propan-2-ol
SpectraBase Compound ID KwlnOrGmoW6
InChI InChI=1S/C15H26O/c1-10-5-7-12(15(3,4)16)9-14-11(2)6-8-13(10)14/h10-12,16H,5-9H2,1-4H3/t10-,11-,12+/m1/s1
InChIKey TWVJWDMOZJXUID-UTUOFQBUSA-N
Mol Weight 222.37 g/mol
Molecular Formula C15H26O
Exact Mass 222.198365 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GM6cSOOhcEH
Name Guaiol
CAS Registry Number 489-86-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H26O
GC Column J&W DB-5 (30 m x 0.25 mm ID x 0.25 ??m film thickness)
GC Oven Program 60 ??C to 246 ??C at 3 ??C/min.
InChI InChI=1S/C15H26O/c1-10-5-7-12(15(3,4)16)9-14-11(2)6-8-13(10)14/h10-12,16H,5-9H2,1-4H3/t10-,11-,12+/m1/s1
InChIKey TWVJWDMOZJXUID-UTUOFQBUSA-N
Molecular Weight 222.372 g/mol
SMILES OC([C@@]1(CC=2[C@](C)(CCC2[C@](C)(CC1)[H])[H])[H])(C)C
SPLASH splash10-0btc-6900000000-3bdbb30d777463edd2ac
Source of Spectrum Adams' Essential Oil Components (GC-MS), Version 4
Wiley ID 1886389