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5,5-Dimethyl-2-cyclohexen-1-one

View entire compound with spectra: 3 NMR, 1 FTIR, and 1 MS (GC)

5,5-Dimethyl-2-cyclohexen-1-one
SpectraBase Compound ID FxD1Ad9JjyK
InChI InChI=1S/C8H12O/c1-8(2)5-3-4-7(9)6-8/h3-4H,5-6H2,1-2H3
InChIKey CDDGRARTNILYAB-UHFFFAOYSA-N
Mol Weight 124.18 g/mol
Molecular Formula C8H12O
Exact Mass 124.088815 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KAtkACx3TF2
Name 5,5-Dimethyl-2-cyclohexen-1-one
CAS Registry Number 4694-17-1
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C8H12O
InChI InChI=1S/C8H12O/c1-8(2)5-3-4-7(9)6-8/h3-4H,5-6H2,1-2H3
InChIKey CDDGRARTNILYAB-UHFFFAOYSA-N
Instrument Name Varian XL-100
Literature Reference J. Torri, M. Azzaro, Bull. Soc. Chim. France 1633 (1974).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3