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2,5-Cyclohexadien-1-one, 4,4-dimethyl-3-phenyl-
SpectraBase Compound ID 6nbchHTOaFI
InChI InChI=1S/C14H14O/c1-14(2)9-8-12(15)10-13(14)11-6-4-3-5-7-11/h3-10H,1-2H3
InChIKey FPHTXLYCNWNALU-UHFFFAOYSA-N
Mol Weight 198.26 g/mol
Molecular Formula C14H14O
Exact Mass 198.104465 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6kDcPclbtgA
Name 2,5-Cyclohexadien-1-one, 4,4-dimethyl-3-phenyl-
Alternate Name(s) 4,4-Dimethyl-3-phenyl-2,5-cyclohexadien-1-one 4,4-Dimethyl-3-phenyl-1-cyclohexa-2,5-dienone 4,4-Dimethyl-3-phenyl-cyclohexa-2,5-dien-1-one
CAS Registry Number 55162-56-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H14O
InChI InChI=1S/C14H14O/c1-14(2)9-8-12(15)10-13(14)11-6-4-3-5-7-11/h3-10H,1-2H3
InChIKey FPHTXLYCNWNALU-UHFFFAOYSA-N
Molecular Weight 198.265 g/mol
SMILES CC1(C)C=CC(C=C1c1ccccc1)=O
SPLASH splash10-0adi-3900000000-108fd3adfe0a7f308a3f
Source of Spectrum SD-1981-0-0
Wiley ID 1196320