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3-(2-Tolyl)-cyclohexanone

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3-(2-Tolyl)-cyclohexanone
SpectraBase Compound ID 7XeMOjYeUNI
InChI InChI=1S/C13H16O/c1-10-5-2-3-8-13(10)11-6-4-7-12(14)9-11/h2-3,5,8,11H,4,6-7,9H2,1H3
InChIKey AVSKXPPDQRTCTE-UHFFFAOYSA-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 7bEK7YVHS2y
Name 3-(2-Methylphenyl)cyclohexanone
Alternate Name(s) 3-(o-tolyl)cyclohexanone 3-(2-Methylphenyl)-1-cyclohexanone 3-(2-Methylphenyl)cyclohexan-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16O
InChI InChI=1S/C13H16O/c1-10-5-2-3-8-13(10)11-6-4-7-12(14)9-11/h2-3,5,8,11H,4,6-7,9H2,1H3
InChIKey AVSKXPPDQRTCTE-UHFFFAOYSA-N
Literature Reference DOI 10.1039/c1cy00214g
Molecular Weight 188.270 g/mol
SMILES C1C(CC(CC1)c1ccccc1C)=O
SPLASH splash10-00le-1900000000-ed19fa622c3940d16ebf
Source of Spectrum CST-1-1605/SM3-5af
Wiley ID 1754155