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3-Benzyl-2-cyclohepten-1-one

View entire compound with spectra: 1 MS (GC)

3-Benzyl-2-cyclohepten-1-one
SpectraBase Compound ID 2LO5Zc1AQPr
InChI InChI=1S/C14H16O/c15-14-9-5-4-8-13(11-14)10-12-6-2-1-3-7-12/h1-3,6-7,11H,4-5,8-10H2
InChIKey XWFFQPHIXRTAMR-UHFFFAOYSA-N
Mol Weight 200.28 g/mol
Molecular Formula C14H16O
Exact Mass 200.120115 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID INW8MVfcI91
Name 3-Benzyl-2-cyclohepten-1-one
Alternate Name(s) 3-(Phenylmethyl)-1-cyclohept-2-enone 3-(Phenylmethyl)cyclohept-2-en-1-one 3-Benzylcyclohept-2-en-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H16O
InChI InChI=1S/C14H16O/c15-14-9-5-4-8-13(11-14)10-12-6-2-1-3-7-12/h1-3,6-7,11H,4-5,8-10H2
InChIKey XWFFQPHIXRTAMR-UHFFFAOYSA-N
Molecular Weight 200.281 g/mol
SMILES C1(C=C(CCCC1)Cc1ccccc1)=O
SPLASH splash10-0aor-9800000000-62ffb5ad8fb47d276514
Source of Spectrum KC-61-10327-20
Wiley ID 1630992