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3-thiazolidinebutanamide, N-(3-chloro-4-fluorophenyl)-4-oxo-5-(2-thienylmethylene)-2-thioxo-, (5E)-
SpectraBase Compound ID DrbVG8QW1If
InChI InChI=1S/C18H14ClFN2O2S3/c19-13-9-11(5-6-14(13)20)21-16(23)4-1-7-22-17(24)15(27-18(22)25)10-12-3-2-8-26-12/h2-3,5-6,8-10H,1,4,7H2,(H,21,23)/b15-10+
InChIKey KIQBMERGARWITO-XNTDXEJSSA-N
Mol Weight 440.95 g/mol
Molecular Formula C18H14ClFN2O2S3
Exact Mass 439.988997 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID LyVHYPo9aQ3
Name 3-thiazolidinebutanamide, N-(3-chloro-4-fluorophenyl)-4-oxo-5-(2-thienylmethylene)-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/C18H14ClFN2O2S3/c19-13-9-11(5-6-14(13)20)21-16(23)4-1-7-22-17(24)15(27-18(22)25)10-12-3-2-8-26-12/h2-3,5-6,8-10H,1,4,7H2,(H,21,23)/b15-10+
InChIKey KIQBMERGARWITO-XNTDXEJSSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_8313_6277
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/10266374