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6,6-Dideuterio-2-cyclohexen-1-one

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6,6-Dideuterio-2-cyclohexen-1-one
SpectraBase Compound ID 41qVcw2HW1s
InChI InChI=1S/C6H8O/c7-6-4-2-1-3-5-6/h2,4H,1,3,5H2/i5D2
InChIKey FWFSEYBSWVRWGL-BFWBPSQCSA-N
Mol Weight 98.14 g/mol
Molecular Formula C6H6D2O
Exact Mass 98.070068 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CjxfwtNNLxB
Name 6,6-Dideuterio-2-cyclohexen-1-one
CAS Registry Number 83350-38-3
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C6H6D2O
InChI InChI=1S/C6H8O/c7-6-4-2-1-3-5-6/h2,4H,1,3,5H2/i5D2
InChIKey FWFSEYBSWVRWGL-BFWBPSQCSA-N
Instrument Name Jeol FX-60
Literature Reference D.A. Forsyth, J.H. Botkin, V.M. Osterman, J. Am. Chem. Soc. 106, 7663 (1984).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3