For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
8a-Methyl-3,3a,4,5,8,8a-hexahydro-2H-azulen-1-one
SpectraBase Compound ID ARS2HOJh8VO
InChI InChI=1S/C11H16O/c1-11-8-4-2-3-5-9(11)6-7-10(11)12/h2,4,9H,3,5-8H2,1H3/t9-,11+/m1/s1
InChIKey WVFOBFKTTHAGIP-KOLCDFICSA-N
Mol Weight 164.25 g/mol
Molecular Formula C11H16O
Exact Mass 164.120115 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID HIbuqDXG6EL
Name 8a-Methyl-3,3a,4,5,8,8a-hexahydro-2H-azulen-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H16O
InChI InChI=1S/C11H16O/c1-11-8-4-2-3-5-9(11)6-7-10(11)12/h2,4,9H,3,5-8H2,1H3/t9-,11+/m1/s1
InChIKey WVFOBFKTTHAGIP-KOLCDFICSA-N
Molecular Weight 164.248 g/mol
SMILES [C@@]12(C(CC[C@]2(CCC=CC1)[H])=O)C
SPLASH splash10-0btd-5900000000-1f451a12704336150d2c
Source of Spectrum F-51-13012-18
Synonyms (3aR,8aS)-8a-Methyl-3,3a,4,5,8,8a-hexahydro-2H-azulen-1-one 8a-methyl-3,3a,4,5,8,8a-hexahydro-1(2H)-azulenone
Wiley ID 794387