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1H-indole-2-carboxylic acid, 3-[(E)-[3-(carboxymethyl)-4-oxo-2-thioxo-5-thiazolidinylidene]methyl]-, methyl ester
SpectraBase Compound ID 8y875i3aJt7
InChI InChI=1S/C16H12N2O5S2/c1-23-15(22)13-9(8-4-2-3-5-10(8)17-13)6-11-14(21)18(7-12(19)20)16(24)25-11/h2-6,17H,7H2,1H3,(H,19,20)/b11-6+
InChIKey LZRRNNQKQHFDJQ-IZZDOVSWSA-N
Mol Weight 376.4 g/mol
Molecular Formula C16H12N2O5S2
Exact Mass 376.018764 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5aqK6Sybx03
Name 1H-indole-2-carboxylic acid, 3-[(E)-[3-(carboxymethyl)-4-oxo-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/C16H12N2O5S2/c1-23-15(22)13-9(8-4-2-3-5-10(8)17-13)6-11-14(21)18(7-12(19)20)16(24)25-11/h2-6,17H,7H2,1H3,(H,19,20)/b11-6+
InChIKey LZRRNNQKQHFDJQ-IZZDOVSWSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_11628_9010
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: F33978; Labnumber: EXGOR1-19517