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3-(2-Tolyl)-cyclohexanone

View entire compound with spectra: 1 NMR, and 2 MS (GC)

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 AQPMVGijt7v
Name 3-(o-Tolyl)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/C5SC01636C
Molecular Weight 188.270 g/mol
SMILES C1(CC(CCC1)c1c(cccc1)C)=O
SPLASH splash10-00le-1900000000-50ea41a9f7422d1eac14
Source of Spectrum CSS-6-5491/SM17-3c
Wiley ID 1801049