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2-((5Z)-5-{[5-(4-nitrophenyl)-2-furyl]methylene}-4-oxo-2-thioxo-1,3-thiazolidin-3-yl)pentanedioic acid
SpectraBase Compound ID K63BMylYPS9
InChI InChI=1S/C19H14N2O8S2/c22-16(23)8-6-13(18(25)26)20-17(24)15(31-19(20)30)9-12-5-7-14(29-12)10-1-3-11(4-2-10)21(27)28/h1-5,7,9,13H,6,8H2,(H,22,23)(H,25,26)/b15-9-
InChIKey AAYFBVCMIGADEC-DHDCSXOGSA-N
Mol Weight 462.45 g/mol
Molecular Formula C19H14N2O8S2
Exact Mass 462.019158 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FnqhuUQZkgH
Name 2-((5Z)-5-{[5-(4-nitrophenyl)-2-furyl]methylene}-4-oxo-2-thioxo-1,3-thiazolidin-3-yl)pentanedioic 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/C19H14N2O8S2/c22-16(23)8-6-13(18(25)26)20-17(24)15(31-19(20)30)9-12-5-7-14(29-12)10-1-3-11(4-2-10)21(27)28/h1-5,7,9,13H,6,8H2,(H,22,23)(H,25,26)/b15-9-
InChIKey AAYFBVCMIGADEC-DHDCSXOGSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_25
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: 601789; Labnumber: EX00004495; VK_ID: VK-000026
Synonyms 2-(5-{[5-(4-nitrophenyl)-2-furyl]methylene}-4-oxo-2-thioxo-1,3-thiazolidin-3-yl)pentanedioic acid
Temperature 308 °C