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[4-((E)-{2,4-dioxo-3-[2-oxo-2-(4-toluidino)ethyl]-1,3-thiazolidin-5-ylidene}methyl)phenoxy]acetic acid
SpectraBase Compound ID Knd4ozu5e6f
InChI InChI=1S/C21H18N2O6S/c1-13-2-6-15(7-3-13)22-18(24)11-23-20(27)17(30-21(23)28)10-14-4-8-16(9-5-14)29-12-19(25)26/h2-10H,11-12H2,1H3,(H,22,24)(H,25,26)/b17-10+
InChIKey JEQYQVUHHZTXKZ-LICLKQGHSA-N
Mol Weight 426.44 g/mol
Molecular Formula C21H18N2O6S
Exact Mass 426.088557 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID LHJPozHq63W
Name [4-((E)-{2,4-dioxo-3-[2-oxo-2-(4-toluidino)ethyl]-1,3-thiazolidin-5-ylidene}methyl)phenoxy]acetic 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/C21H18N2O6S/c1-13-2-6-15(7-3-13)22-18(24)11-23-20(27)17(30-21(23)28)10-14-4-8-16(9-5-14)29-12-19(25)26/h2-10H,11-12H2,1H3,(H,22,24)(H,25,26)/b17-10+
InChIKey JEQYQVUHHZTXKZ-LICLKQGHSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_11579
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: 1003980; UBI_ID: UBI-011582
Synonyms [4-({2,4-dioxo-3-[2-oxo-2-(4-toluidino)ethyl]-1,3-thiazolidin-5-ylidene}methyl)phenoxy]acetic acid
Temperature 308 °C