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Benzylcyclohexenone
SpectraBase Compound ID xqPkNQ0Vqw
InChI InChI=1S/C13H14O/c14-13-9-5-4-8-12(13)10-11-6-2-1-3-7-11/h1-3,6-8H,4-5,9-10H2
InChIKey VQXQHTJRQCNWEG-UHFFFAOYSA-N
Mol Weight 186.25 g/mol
Molecular Formula C13H14O
Exact Mass 186.104465 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HwB3E0oykvH
Name Benzylcyclohexenone
Alternate Name(s) 2-Benzyl-2-cyclohexenone 2-Benzyl-2-cyclohexen-1-one 2-(Phenylmethyl)-1-cyclohex-2-enone 2-(Phenylmethyl)cyclohex-2-en-1-one
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Formula C13H14O
InChI InChI=1S/C13H14O/c14-13-9-5-4-8-12(13)10-11-6-2-1-3-7-11/h1-3,6-8H,4-5,9-10H2
InChIKey VQXQHTJRQCNWEG-UHFFFAOYSA-N
Molecular Weight 186.254 g/mol
SMILES C1(C(=CCCC1)Cc1ccccc1)=O
SPLASH splash10-00ou-8900000000-dee709f17647a37275eb
Source of Spectrum F-56-10205-0
Wiley ID 859520