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4-Methyl-4-phenyl-2-cyclohexen-1-one

View entire compound with spectra: 7 NMR, 1 FTIR, and 2 MS (GC)

4-Methyl-4-phenyl-2-cyclohexen-1-one
SpectraBase Compound ID 4sMMjLrwRk8
InChI InChI=1S/C13H14O/c1-13(9-7-12(14)8-10-13)11-5-3-2-4-6-11/h2-7,9H,8,10H2,1H3
InChIKey NTASQMWLMVNJSS-UHFFFAOYSA-N
Mol Weight 186.25 g/mol
Molecular Formula C13H14O
Exact Mass 186.104465 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3pdoyTbwb2i
Name 4-Methyl-4-phenyl-2-cyclohexen-1-one
CAS Registry Number 17429-36-6
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C13H14O
InChI InChI=1S/C13H14O/c1-13(9-7-12(14)8-10-13)11-5-3-2-4-6-11/h2-7,9H,8,10H2,1H3
InChIKey NTASQMWLMVNJSS-UHFFFAOYSA-N
Instrument Name Varian CFT-20
Literature Reference W. Gramlich, Liebigs Ann. Chem. 121 (1979).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3