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2-(1-Hydroxy-3-phenylpropyl)-2-cyclohexen-1-one
SpectraBase Compound ID HUDFBh837Y8
InChI InChI=1S/C15H18O2/c16-14-9-5-4-8-13(14)15(17)11-10-12-6-2-1-3-7-12/h1-3,6-8,15,17H,4-5,9-11H2
InChIKey LQVJMYBTRCWNIH-UHFFFAOYSA-N
Mol Weight 230.31 g/mol
Molecular Formula C15H18O2
Exact Mass 230.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 91HKf30l8Xl
Name 2-(1-Hydroxy-3-phenylpropyl)-2-cyclohexen-1-one
Alternate Name(s) 2-(1-hydroxy-3-phenylpropyl)-1-cyclohex-2-enone 2-(1-hydroxy-3-phenylpropyl)cyclohex-2-en-1-one 2-(1-oxidanyl-3-phenyl-propyl)cyclohex-2-en-1-one
Comments Less than 3 mono-isotopic peaks
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Formula C15H18O2
InChI InChI=1S/C15H18O2/c16-14-9-5-4-8-13(14)15(17)11-10-12-6-2-1-3-7-12/h1-3,6-8,15,17H,4-5,9-11H2
InChIKey LQVJMYBTRCWNIH-UHFFFAOYSA-N
Molecular Weight 230.307 g/mol
SMILES OC(C=1C(=O)CCCC1)CCc1ccccc1
SPLASH splash10-03di-0090000000-fcc0f672c5a88e7ec752
Source of Spectrum F-54-11822-31
Wiley ID 809061