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2-({4-[(5Z)-5-(2-furylmethylene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]butanoyl}amino)benzoic acid
SpectraBase Compound ID 1auowAVmyMp
InChI InChI=1S/C19H16N2O5S2/c22-16(20-14-7-2-1-6-13(14)18(24)25)8-3-9-21-17(23)15(28-19(21)27)11-12-5-4-10-26-12/h1-2,4-7,10-11H,3,8-9H2,(H,20,22)(H,24,25)/b15-11-
InChIKey VNMYZUCXXKBSJZ-PTNGSMBKSA-N
Mol Weight 416.47 g/mol
Molecular Formula C19H16N2O5S2
Exact Mass 416.050064 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID IrQjJpXA1VK
Name 2-({4-[(5Z)-5-(2-furylmethylene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]butanoyl}amino)benzoic acid
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/C19H16N2O5S2/c22-16(20-14-7-2-1-6-13(14)18(24)25)8-3-9-21-17(23)15(28-19(21)27)11-12-5-4-10-26-12/h1-2,4-7,10-11H,3,8-9H2,(H,20,22)(H,24,25)/b15-11-
InChIKey VNMYZUCXXKBSJZ-PTNGSMBKSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_10997
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: E04287; Labnumber: EXGOR-0289; SBI_ID: SBI-011000
Synonyms 2-({4-[5-(2-furylmethylene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]butanoyl}amino)benzoic acid
Temperature 308 °C