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4-Methylcyclohexanone
SpectraBase Compound ID HVl1Dn1ecrQ
InChI InChI=1S/C7H12O/c1-6-2-4-7(8)5-3-6/h6H,2-5H2,1H3
InChIKey VGVHNLRUAMRIEW-UHFFFAOYSA-N
Mol Weight 112.17 g/mol
Molecular Formula C7H12O
Exact Mass 112.088815 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KDWacZ87vDK
Name 4-Methylcyclohexanone
CAS Registry Number 589-92-4
Comments ANELVA NV-21 SPECTROMETER (22.6 MHZ)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C7H12O
InChI InChI=1S/C7H12O/c1-6-2-4-7(8)5-3-6/h6H,2-5H2,1H3
InChIKey VGVHNLRUAMRIEW-UHFFFAOYSA-N
Instrument Name see comment
Literature Reference S. Ueji, M. Kitadani, M. Sugiura, J. Chem. Soc. Perkin II 425 (1989).
NMR Standard Benzene-D6
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent Benzene-D6