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1,2-Cyclohexanedione

View entire compound with spectra: 19 NMR, and 1 MS (GC)

1,2-Cyclohexanedione
SpectraBase Compound ID 1ghzxJlwdx4
InChI InChI=1S/C6H8O2/c7-5-3-1-2-4-6(5)8/h3,7H,1-2,4H2
InChIKey JQPFYXFVUKHERX-UHFFFAOYSA-N
Mol Weight 112.13 g/mol
Molecular Formula C6H8O2
Exact Mass 112.052429 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BvuOpMsJ8Xj
Name 2-Hydroxy-cyclohex-2-en-1-one
CAS Registry Number 10316-66-2
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C6H8O2
InChI InChI=1S/C6H8O2/c7-5-3-1-2-4-6(5)8/h3,7H,1-2,4H2
InChIKey JQPFYXFVUKHERX-UHFFFAOYSA-N
Instrument Name Varian XL-100
Literature Reference J. Polonsky, Z. Baskevitch, E. Wenkert, J. Org. Chem. 40, 2499 (1975).
NMR Standard CHCl3
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CHCl3