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4-Phenyl-1-(3-tolyl)-butan-1-one
SpectraBase Compound ID AFUlPgpFhIp
InChI InChI=1S/C17H18O/c1-14-7-5-11-16(13-14)17(18)12-6-10-15-8-3-2-4-9-15/h2-5,7-9,11,13H,6,10,12H2,1H3
InChIKey KKOLSWQXPOCKFN-UHFFFAOYSA-N
Mol Weight 238.33 g/mol
Molecular Formula C17H18O
Exact Mass 238.135765 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KMTD4GEU9jz
Name 4-Phenyl-1-(3-tolyl)-butan-1-one
Alternate Name(s) 4-Phenyl-1-(m-tolyl)butan-1-one 1-(3-Methylphenyl)-4-phenyl-1-butanone 1-(3-Methylphenyl)-4-phenylbutan-1-one 1-(3-Methylphenyl)-4-phenyl-butan-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H18O
InChI InChI=1S/C17H18O/c1-14-7-5-11-16(13-14)17(18)12-6-10-15-8-3-2-4-9-15/h2-5,7-9,11,13H,6,10,12H2,1H3
InChIKey KKOLSWQXPOCKFN-UHFFFAOYSA-N
Literature Reference DOI 10.1002/adsc.201000429
Molecular Weight 238.330 g/mol
SMILES C(c1cc(ccc1)C)(CCCc1ccccc1)=O
SPLASH splash10-00kr-2690000000-106673e18522bd6e4938
Source of Spectrum ASC-353-57/SM7-3ac
Wiley ID 1764543