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6-tert-Butyl-3,6-dimethyl-2-cyclohexen-1-one

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6-tert-Butyl-3,6-dimethyl-2-cyclohexen-1-one
SpectraBase Compound ID JwepVpPRGZb
InChI InChI=1S/C12H20O/c1-9-6-7-12(5,10(13)8-9)11(2,3)4/h8H,6-7H2,1-5H3
InChIKey ZMYLJJIBJRBLPJ-UHFFFAOYSA-N
Mol Weight 180.29 g/mol
Molecular Formula C12H20O
Exact Mass 180.151415 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ICSoN28y5eC
Name 6-tert-Butyl-3,6-dimethyl-2-cyclohexen-1-one
CAS Registry Number 81360-70-5
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C12H20O
InChI InChI=1S/C12H20O/c1-9-6-7-12(5,10(13)8-9)11(2,3)4/h8H,6-7H2,1-5H3
InChIKey ZMYLJJIBJRBLPJ-UHFFFAOYSA-N
Instrument Name Jeol FX-90
Literature Reference J.P. Marino, J.C. Jaen, J. Am. Chem. Soc. 104, 3165 (1982).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3