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4-[({(2E)-3-methyl-2-[(E)-methylimino]-4-oxo-1,3-thiazolidin-5-yl}acetyl)amino]benzoic acid
SpectraBase Compound ID DidSuB0OXgo
InChI InChI=1S/C14H15N3O4S/c1-15-14-17(2)12(19)10(22-14)7-11(18)16-9-5-3-8(4-6-9)13(20)21/h3-6,10H,7H2,1-2H3,(H,16,18)(H,20,21)/b15-14+
InChIKey ZLKFZHYLGOZPNM-CCEZHUSRSA-N
Mol Weight 321.35 g/mol
Molecular Formula C14H15N3O4S
Exact Mass 321.078327 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5NguBCAa3BL
Name 4-[({(2E)-3-methyl-2-[(E)-methylimino]-4-oxo-1,3-thiazolidin-5-yl}acetyl)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/C14H15N3O4S/c1-15-14-17(2)12(19)10(22-14)7-11(18)16-9-5-3-8(4-6-9)13(20)21/h3-6,10H,7H2,1-2H3,(H,16,18)(H,20,21)/b15-14+
InChIKey ZLKFZHYLGOZPNM-CCEZHUSRSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_ASIOH_7000_83
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: ZI/8047313; Labnumber: LD-1400065; IOH_ID: IOH-000084
Synonyms 4-[({3-methyl-2-[methylimino]-4-oxo-1,3-thiazolidin-5-yl}acetyl)amino]benzoic acid
Temperature 303 °C