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3,5,5-Trimethyl-2-cyclohexen-1-one
SpectraBase Compound ID ClwX0E72fmw
InChI InChI=1S/C9H14O/c1-7-4-8(10)6-9(2,3)5-7/h4H,5-6H2,1-3H3
InChIKey HJOVHMDZYOCNQW-UHFFFAOYSA-N
Mol Weight 138.21 g/mol
Molecular Formula C9H14O
Exact Mass 138.104465 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BXU0h3qoPkJ
Name 3,5,5-Trimethyl-2-cyclohexen-1-one
CAS Registry Number 78-59-1
Comments 1,2-DICHLOROETHANE AS SOLVENT, ANELVA NV-21 SPECTROMETER (22.6 MHZ)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C9H14O
InChI InChI=1S/C9H14O/c1-7-4-8(10)6-9(2,3)5-7/h4H,5-6H2,1-3H3
InChIKey HJOVHMDZYOCNQW-UHFFFAOYSA-N
Instrument Name see comment
Literature Reference S. Ueji, M. Kitadani, M. Sugiura, J. Chem. Soc. Perkin II 425 (1989).
NMR Standard D2O
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany