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3-thiazolidinehexanoic acid, 5-[(4-chloro-3-nitrophenyl)methylene]-4-oxo-2-thioxo-, (5Z)-
SpectraBase Compound ID 2moIokfGF3P
InChI InChI=1S/C16H15ClN2O5S2/c17-11-6-5-10(8-12(11)19(23)24)9-13-15(22)18(16(25)26-13)7-3-1-2-4-14(20)21/h5-6,8-9H,1-4,7H2,(H,20,21)/b13-9-
InChIKey VUEMSCYHQRVQLV-LCYFTJDESA-N
Mol Weight 414.88 g/mol
Molecular Formula C16H15ClN2O5S2
Exact Mass 414.011092 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID AdERNURnI0T
Name 3-thiazolidinehexanoic acid, 5-[(4-chloro-3-nitrophenyl)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/C16H15ClN2O5S2/c17-11-6-5-10(8-12(11)19(23)24)9-13-15(22)18(16(25)26-13)7-3-1-2-4-14(20)21/h5-6,8-9H,1-4,7H2,(H,20,21)/b13-9-
InChIKey VUEMSCYHQRVQLV-LCYFTJDESA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_8313_6498
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/10266961