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3-(6,6-Dimethyl-5-oxohept-2-enyl)-cyclohexanone
SpectraBase Compound ID Axww2wEeXFm
InChI InChI=1S/C15H24O2/c1-15(2,3)14(17)10-5-4-7-12-8-6-9-13(16)11-12/h4-5,12H,6-11H2,1-3H3/b5-4+
InChIKey VFYSPNFFKAHOOB-SNAWJCMRSA-N
Mol Weight 236.35 g/mol
Molecular Formula C15H24O2
Exact Mass 236.17763 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CQfYX2L8UXH
Name 3-(6,6-Dimethyl-5-oxohept-2-enyl)-cyclohexanone
CAS Registry Number 83040-95-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H24O2
InChI InChI=1S/C15H24O2/c1-15(2,3)14(17)10-5-4-7-12-8-6-9-13(16)11-12/h4-5,12H,6-11H2,1-3H3/b5-4+
InChIKey VFYSPNFFKAHOOB-SNAWJCMRSA-N
Molecular Weight 236.355 g/mol
SMILES C(=O)(C\C=C\CC1CCCC(=O)C1)C(C)(C)C
SPLASH splash10-0a4i-9200000000-6a68b67c85ee754f72f2
Synonyms 3-[(2E)-6,6-Dimethyl-5-oxo-2-heptenyl]cyclohexanone 3-[(E)-5-keto-6,6-dimethyl-hept-2-enyl]cyclohexanone 3-[(E)-6,6-dimethyl-5-oxidanylidene-hept-2-enyl]cyclohexan-1-one 3-[(E)-6,6-dimethyl-5-oxo-hept-2-enyl]cyclohexanone 3-[(E)-6,6-dimethyl-5-oxohept-2-enyl]-1-cyclohexanone 3-[(E)-6,6-dimethyl-5-oxohept-2-enyl]cyclohexan-1-one
Wiley ID 1482004