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6-Hepten-2-one, 7-phenyl-

View entire compound with spectra: 1 MS (GC)

6-Hepten-2-one, 7-phenyl-
SpectraBase Compound ID GPgevq9JbN0
InChI InChI=1S/C13H16O/c1-12(14)8-4-2-5-9-13-10-6-3-7-11-13/h3,5-7,9-11H,2,4,8H2,1H3/b9-5+
InChIKey JNKOHTRLXCXPIP-WEVVVXLNSA-N
Mol Weight 188.27 g/mol
Molecular Formula C13H16O
Exact Mass 188.120115 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CMRRXMz4KV9
Name 6-Hepten-2-one, 7-phenyl-
Alternate Name(s) (6E)-7-Phenyl-6-hepten-2-one (E)-7-phenyl-6-hepten-2-one (E)-7-phenylhept-6-en-2-one
CAS Registry Number 33046-88-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16O
InChI InChI=1S/C13H16O/c1-12(14)8-4-2-5-9-13-10-6-3-7-11-13/h3,5-7,9-11H,2,4,8H2,1H3/b9-5+
InChIKey JNKOHTRLXCXPIP-WEVVVXLNSA-N
Molecular Weight 188.270 g/mol
SMILES CC(=O)CCC\C=C\c1ccccc1
SPLASH splash10-001i-1900000000-1a9a5c65a3df9a2e8b50
Source of Spectrum SD-1981-0-0
Wiley ID 1185081