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(E)-5-Phenylsulfonyl-3-cyclohexene-1-carboxylic acid, methyl ester

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(E)-5-Phenylsulfonyl-3-cyclohexene-1-carboxylic acid, methyl ester
SpectraBase Compound ID 8Rt7J3tAsM7
InChI InChI=1S/C14H16O4S/c1-18-14(15)11-6-5-9-13(10-11)19(16,17)12-7-3-2-4-8-12/h2-5,7-9,11,13H,6,10H2,1H3
InChIKey NSBBIXSLQMHWGE-UHFFFAOYSA-N
Mol Weight 280.34 g/mol
Molecular Formula C14H16O4S
Exact Mass 280.07693 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AHOq3HllbL1
Name (E)-5-Phenylsulfonyl-3-cyclohexene-1-carboxylic acid, methyl ester
Copyright Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved.
Formula C14H16O4S
InChI InChI=1S/C14H16O4S/c1-18-14(15)11-6-5-9-13(10-11)19(16,17)12-7-3-2-4-8-12/h2-5,7-9,11,13H,6,10H2,1H3
InChIKey NSBBIXSLQMHWGE-UHFFFAOYSA-N
Instrument Name Jeol FX-60
Literature Reference B.M. Trost, N.R. Schmuff, J. Am. Chem. Soc. 107, 396 (1985).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3