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6(1H)-Azulenone, 1-(acetyloxy)-2,3,5,7,8,8a-hexahydro-1,4-dimethyl-7-(1-methylethylidene)-, cis-(.+-.)-
SpectraBase Compound ID 8t9bibcVCpl
InChI InChI=1S/C17H24O3/c1-10(2)14-9-15-13(11(3)8-16(14)19)6-7-17(15,5)20-12(4)18/h15H,6-9H2,1-5H3/t15-,17+/m0/s1
InChIKey LCARQDVVQOJBOM-DOTOQJQBSA-N
Mol Weight 276.38 g/mol
Molecular Formula C17H24O3
Exact Mass 276.172545 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7zCXqoal4h
Name 6(1H)-Azulenone, 1-(acetyloxy)-2,3,5,7,8,8a-hexahydro-1,4-dimethyl-7-(1-methylethylidene)-, cis-(.+-.)-
CAS Registry Number 115842-58-5
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H24O3
InChI InChI=1S/C17H24O3/c1-10(2)14-9-15-13(11(3)8-16(14)19)6-7-17(15,5)20-12(4)18/h15H,6-9H2,1-5H3/t15-,17+/m0/s1
InChIKey LCARQDVVQOJBOM-DOTOQJQBSA-N
Molecular Weight 276.376 g/mol
SMILES C=12[C@@]([C@@](OC(=O)C)(C)CC2)(CC(=C(C)C)C(CC1C)=O)[H]
SPLASH splash10-0gb9-0090000000-0dfdb17ba9a96e38801a
Source of Spectrum F-43-4431-15
Synonyms (1R,8aS)-1,4-dimethyl-7-(1-methylethylidene)-6-oxo-1,2,3,5,6,7,8,8a-octahydro-1-azulenyl acetate 4-(dimethylmethylene)-1,7-dimethyl-1-acetoxybicyclo[5.3.0]deca-7-en-3-one 4-(dimethylmethylene)-1,7-dimethyl-7-acetoxybicyclo[5.3.0]dec-7-en-2-one
Wiley ID 1280328