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(2E)-2-[(5E)-5-(2-chlorobenzylidene)-4-oxo-3-phenyl-1,3-thiazolidin-2-ylidene]-2-cyano-N-(3,4-dimethylphenyl)ethanamide
SpectraBase Compound ID 9BH9Rhn46Ex
InChI InChI=1S/C27H20ClN3O2S/c1-17-12-13-20(14-18(17)2)30-25(32)22(16-29)27-31(21-9-4-3-5-10-21)26(33)24(34-27)15-19-8-6-7-11-23(19)28/h3-15H,1-2H3,(H,30,32)/b24-15+,27-22+
InChIKey GXDBONHDWSYJMM-TUECKBEMSA-N
Mol Weight 485.99 g/mol
Molecular Formula C27H20ClN3O2S
Exact Mass 485.096476 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4dh3CfCKJvi
Name (2E)-2-[(5E)-5-(2-chlorobenzylidene)-4-oxo-3-phenyl-1,3-thiazolidin-2-ylidene]-2-cyano-N-(3,4-dimethylphenyl)ethanamide
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/C27H20ClN3O2S/c1-17-12-13-20(14-18(17)2)30-25(32)22(16-29)27-31(21-9-4-3-5-10-21)26(33)24(34-27)15-19-8-6-7-11-23(19)28/h3-15H,1-2H3,(H,30,32)/b24-15+,27-22+
InChIKey GXDBONHDWSYJMM-TUECKBEMSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_26717
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: D66557; Labnumber: EXP17Mat000970; SBI_ID: SBI-026721
Synonyms 2-[5-(2-chlorobenzylidene)-4-oxo-3-phenyl-1,3-thiazolidin-2-ylidene]-2-cyano-N-(3,4-dimethylphenyl)ethanamide
Temperature 318 °C