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3-CARBOMETHOXY-2-CYCLOHEXYL-2,5-DIHYDROTHIOPHENE-1,1-DIOXIDE

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3-CARBOMETHOXY-2-CYCLOHEXYL-2,5-DIHYDROTHIOPHENE-1,1-DIOXIDE
SpectraBase Compound ID CfV31lxhB7r
InChI InChI=1S/C12H18O4S/c1-16-12(13)10-7-8-17(14,15)11(10)9-5-3-2-4-6-9/h7,9,11H,2-6,8H2,1H3
InChIKey FDZVTKSFGODIDM-UHFFFAOYSA-N
Mol Weight 258.33 g/mol
Molecular Formula C12H18O4S
Exact Mass 258.09258 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EnhlFXlG1RH
Name 2-Cyclohexyl-2,5-dihydro-thiophene-1,1-dioxide-3-carboxylic acid, methyl ester
CAS Registry Number 67488-52-2
Comments BRUKER CXP-100
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C12H18O4S
InChI InChI=1S/C12H18O4S/c1-16-12(13)10-7-8-17(14,15)11(10)9-5-3-2-4-6-9/h7,9,11H,2-6,8H2,1H3
InChIKey FDZVTKSFGODIDM-UHFFFAOYSA-N
Instrument Name see comment
Literature Reference J. Mc Intosh, Can. J. Chem. 57, 131 (1979).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3