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6(1H)-Azulenone, 8-(acetyloxy)-2,4,5,7,8,8a-hexahydro-3,8-dimethyl-5-(1-methylethylidene)-, cis-(.+-.)-
SpectraBase Compound ID 4UAPZzJaCpY
InChI InChI=1S/C17H24O3/c1-10(2)13-8-14-11(3)6-7-15(14)17(5,9-16(13)19)20-12(4)18/h15H,6-9H2,1-5H3/t15-,17+/m0/s1
InChIKey UFNYXYJBIIJUAJ-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 GEDwvcjQUQj
Name 6(1H)-Azulenone, 8-(acetyloxy)-2,4,5,7,8,8a-hexahydro-3,8-dimethyl-5-(1-methylethylidene)-, cis-(.+-.)-
CAS Registry Number 115842-51-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H24O3
InChI InChI=1S/C17H24O3/c1-10(2)13-8-14-11(3)6-7-15(14)17(5,9-16(13)19)20-12(4)18/h15H,6-9H2,1-5H3/t15-,17+/m0/s1
InChIKey UFNYXYJBIIJUAJ-DOTOQJQBSA-N
Molecular Weight 276.376 g/mol
SMILES C=12[C@@]([C@@](CC(C(C2)=C(C)C)=O)(OC(=O)C)C)(CCC1C)[H]
SPLASH splash10-01b9-0390000000-038f8f5a8a3d2a2e70ba
Source of Spectrum F-43-4430-6
Synonyms (3aS,4R)-1,4-dimethyl-7-(1-methylethylidene)-6-oxo-2,3,3a,4,5,6,7,8-octahydro-4-azulenyl acetate 1,7-Dimethyl-1-acetoxy-4-(dimethylmethylene)bicyclo[5.3.0]dec-7-en-3-one
Wiley ID 1280326