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3-thiazolidinebutanoic acid, 5-[[3-(4-chlorophenyl)-1-phenyl-1H-pyrazol-4-yl]methylene]-4-oxo-2-thioxo-, (5Z)-
SpectraBase Compound ID 1ARHXyAOjad
InChI InChI=1S/C23H18ClN3O3S2/c24-17-10-8-15(9-11-17)21-16(14-27(25-21)18-5-2-1-3-6-18)13-19-22(30)26(23(31)32-19)12-4-7-20(28)29/h1-3,5-6,8-11,13-14H,4,7,12H2,(H,28,29)/b19-13-
InChIKey FSRVYXQOXYGCLR-UYRXBGFRSA-N
Mol Weight 483.99 g/mol
Molecular Formula C23H18ClN3O3S2
Exact Mass 483.047811 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID I0cemKGGIxh
Name 3-thiazolidinebutanoic acid, 5-[[3-(4-chlorophenyl)-1-phenyl-1H-pyrazol-4-yl]methylene]-4-oxo-2-thioxo-, (5Z)-
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/C23H18ClN3O3S2/c24-17-10-8-15(9-11-17)21-16(14-27(25-21)18-5-2-1-3-6-18)13-19-22(30)26(23(31)32-19)12-4-7-20(28)29/h1-3,5-6,8-11,13-14H,4,7,12H2,(H,28,29)/b19-13-
InChIKey FSRVYXQOXYGCLR-UYRXBGFRSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB3_9000_1836
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/11268206