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1,5-Dichloro-4-hydroxy-5-methyl-2-oxo-cyclohexan
SpectraBase Compound ID LL496SS4rEn
InChI InChI=1S/C9H12Cl2O4/c1-8(10)4-9(11,7(14)15-2)6(13)3-5(8)12/h5,12H,3-4H2,1-2H3
InChIKey KRTWLAVLUKFWGW-UHFFFAOYSA-N
Mol Weight 255.1 g/mol
Molecular Formula C9H12Cl2O4
Exact Mass 254.011264 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9Ojbyuw7v3
Name 1,5-Dichloro-4-hydroxy-5-methyl-2-oxo-cyclohexane-1-carboxylic acid, methyl ester
Comments VARIAN EM-390 OR XL-300 SPECTROMETER, LESS POLAR DIASTEREOMER
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C9H12Cl2O4
InChI InChI=1S/C9H12Cl2O4/c1-8(10)4-9(11,7(14)15-2)6(13)3-5(8)12/h5,12H,3-4H2,1-2H3
InChIKey KRTWLAVLUKFWGW-UHFFFAOYSA-N
Instrument Name see comment
Literature Reference B.B. Snider, J.J. Patricia, J. Org. Chem. 54, 38 (1989).
NMR Standard not reported
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent not reported