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(1RS, 2Sr,3sr)-5-methyl-3-(1'-tosyl-indol-3'-yl)-cyclohex-4-ene-1,2-dicarboxylic acid, 1-methyl ester
SpectraBase Compound ID CnCEn0kEv8l
InChI InChI=1S/C25H25NO6S/c1-15-8-10-17(11-9-15)33(30,31)26-14-21(18-6-4-5-7-22(18)26)19-12-16(2)13-20(25(29)32-3)23(19)24(27)28/h4-12,14,19-20,23H,13H2,1-3H3,(H,27,28)
InChIKey CDYUTZNXSKODRU-UHFFFAOYSA-N
Mol Weight 467.54 g/mol
Molecular Formula C25H25NO6S
Exact Mass 467.140259 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5vcW4vCivgD
Name (1RS, 2Sr,3sr)-5-methyl-3-(1'-tosyl-indol-3'-yl)-cyclohex-4-ene-1,2-dicarboxylic acid, 1-methyl ester
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C25H25NO6S
InChI InChI=1S/C25H25NO6S/c1-15-8-10-17(11-9-15)33(30,31)26-14-21(18-6-4-5-7-22(18)26)19-12-16(2)13-20(25(29)32-3)23(19)24(27)28/h4-12,14,19-20,23H,13H2,1-3H3,(H,27,28)
InChIKey CDYUTZNXSKODRU-UHFFFAOYSA-N
Instrument Name Jeol FX-90
Literature Reference K-F. Cheng, T-T. Wong, W-T. Wong, J. Chem. Soc. Perkin I 2487 (1990).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3