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DIMETHYL-1-BETA-METHOXY-4-ALPHA-[(4'-METHYLBENZENESULFONYL)-AMINO]-CYCLOHEX-5-ENE-1,2-DICARBOXYLATE
SpectraBase Compound ID 4aH6Ccba3wO
InChI InChI=1S/C18H23NO7S/c1-12-5-7-14(8-6-12)27(22,23)19-13-9-10-18(26-4,17(21)25-3)15(11-13)16(20)24-2/h5-10,13,15,19H,11H2,1-4H3
InChIKey LXWKATRBQRXADI-UHFFFAOYSA-N
Mol Weight 397.44 g/mol
Molecular Formula C18H23NO7S
Exact Mass 397.119523 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IyLPnNqg1cg
Name DIMETHYL-1-BETA-METHOXY-4-ALPHA-[(4'-METHYLBENZENESULFONYL)-AMINO]-CYCLOHEX-5-ENE-1,2-DICARBOXYLATE
CAS Registry Number 141667-65-4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H23NO7S
InChI InChI=1S/C18H23NO7S/c1-12-5-7-14(8-6-12)27(22,23)19-13-9-10-18(26-4,17(21)25-3)15(11-13)16(20)24-2/h5-10,13,15,19H,11H2,1-4H3
InChIKey LXWKATRBQRXADI-UHFFFAOYSA-N
Literature Reference Author G.H.POSNER,V.VINADER,K.AFARINKIA
Literature Reference Citation J.ORG.CHEM.,57,4088(1992)
Literature Reference DOI 10.1021/jo00041a010
Molecular Weight 397.443 g/mol
Solvent CDCl3
Source File Reference UWCS3830