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2-thiophenecarboxylic acid, 2-methoxy-4-[(E)-(4-oxo-3-phenyl-2-thioxo-5-thiazolidinylidene)methyl]phenyl ester
SpectraBase Compound ID LjIT6mRRQPC
InChI InChI=1S/C22H15NO4S3/c1-26-17-12-14(9-10-16(17)27-21(25)18-8-5-11-29-18)13-19-20(24)23(22(28)30-19)15-6-3-2-4-7-15/h2-13H,1H3/b19-13+
InChIKey SMKLPNVUGDHBLF-CPNJWEJPSA-N
Mol Weight 453.55 g/mol
Molecular Formula C22H15NO4S3
Exact Mass 453.016321 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID fC3ngoECla
Name 2-thiophenecarboxylic acid, 2-methoxy-4-[(E)-(4-oxo-3-phenyl-2-thioxo-5-thiazolidinylidene)methyl]phenyl 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/C22H15NO4S3/c1-26-17-12-14(9-10-16(17)27-21(25)18-8-5-11-29-18)13-19-20(24)23(22(28)30-19)15-6-3-2-4-7-15/h2-13H,1H3/b19-13+
InChIKey SMKLPNVUGDHBLF-CPNJWEJPSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_3517_2
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: NMR/10278986