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1H-indole-2-carboxylic acid, 6-methoxy-3-[(E)-[4-oxo-3-(2-phenylethyl)-2-thioxo-5-thiazolidinylidene]methyl]-, methyl ester

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1H-indole-2-carboxylic acid, 6-methoxy-3-[(E)-[4-oxo-3-(2-phenylethyl)-2-thioxo-5-thiazolidinylidene]methyl]-, methyl ester
SpectraBase Compound ID CPiWM3NXGZg
InChI InChI=1S/C23H20N2O4S2/c1-28-15-8-9-16-17(20(22(27)29-2)24-18(16)12-15)13-19-21(26)25(23(30)31-19)11-10-14-6-4-3-5-7-14/h3-9,12-13,24H,10-11H2,1-2H3/b19-13+
InChIKey WJABGWYQSMWXPH-CPNJWEJPSA-N
Mol Weight 452.54 g/mol
Molecular Formula C23H20N2O4S2
Exact Mass 452.086449 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HjdyMy6WIU2
Name 1H-indole-2-carboxylic acid, 6-methoxy-3-[(E)-[4-oxo-3-(2-phenylethyl)-2-thioxo-5-thiazolidinylidene]methyl]-, methyl ester
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C23H20N2O4S2/c1-28-15-8-9-16-17(20(22(27)29-2)24-18(16)12-15)13-19-21(26)25(23(30)31-19)11-10-14-6-4-3-5-7-14/h3-9,12-13,24H,10-11H2,1-2H3/b19-13+
InChIKey WJABGWYQSMWXPH-CPNJWEJPSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_11628_9007
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: F33973; Labnumber: EXGOR1-19278