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2-(3-PHENYLPROPIONYL)-1,3-CACLOHEXANEDIONE
SpectraBase Compound ID H6RUkKqDrKx
InChI InChI=1S/C15H16O3/c16-12-7-4-8-13(17)15(12)14(18)10-9-11-5-2-1-3-6-11/h1-3,5-6,16H,4,7-10H2
InChIKey XWEVHMSPHBTKNY-UHFFFAOYSA-N
Mol Weight 244.29 g/mol
Molecular Formula C15H16O3
Exact Mass 244.109944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D6Vf36XVt5u
Name 3-hydroxy-2-(3-phenylpropanoyl)cyclohex-2-en-1-one
Appearance Pale yellow gum
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Formula C15H16O3
InChI InChI=1S/C15H16O3/c16-12-7-4-8-13(17)15(12)14(18)10-9-11-5-2-1-3-6-11/h1-3,5-6,16H,4,7-10H2
InChIKey XWEVHMSPHBTKNY-UHFFFAOYSA-N
Instrument Name JEOL LMS-FABmate
Ionization Type EI
Literature Reference DOI 10.1021/np050283e
Molecular Weight 244.290 g/mol
Reported Formula C15H16O3
SMILES OC1=C(C(CCc2ccccc2)=O)C(CCC1)=O
SPLASH splash10-01p6-2960000000-eca7c9b3214f4ba90521
Source of Spectrum G4-68-1659-6
Wiley ID 1881953