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3-thiazolidineacetic acid, 4-oxo-alpha-(phenylmethyl)-5-(6-quinolinylmethylene)-2-thioxo-, (5E)-
SpectraBase Compound ID CWIINERTBsk
InChI InChI=1S/C22H16N2O3S2/c25-20-19(13-15-8-9-17-16(11-15)7-4-10-23-17)29-22(28)24(20)18(21(26)27)12-14-5-2-1-3-6-14/h1-11,13,18H,12H2,(H,26,27)/b19-13+
InChIKey IVFMKTUAYIQIGK-CPNJWEJPSA-N
Mol Weight 420.5 g/mol
Molecular Formula C22H16N2O3S2
Exact Mass 420.060235 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID G15C56mv9tw
Name 3-thiazolidineacetic acid, 4-oxo-alpha-(phenylmethyl)-5-(6-quinolinylmethylene)-2-thioxo-, (5E)-
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/C22H16N2O3S2/c25-20-19(13-15-8-9-17-16(11-15)7-4-10-23-17)29-22(28)24(20)18(21(26)27)12-14-5-2-1-3-6-14/h1-11,13,18H,12H2,(H,26,27)/b19-13+
InChIKey IVFMKTUAYIQIGK-CPNJWEJPSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_11628_4034
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: F19883; Labnumber: EXGOR1-18182