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(5Z)-2-[4-chloro-2-(trifluoromethyl)anilino]-5-[(2E)-2-methyl-3-phenyl-2-propenylidene]-1,3-thiazol-4(5H)-one
SpectraBase Compound ID JdzU6ogX3Tt
InChI InChI=1S/C20H14ClF3N2OS/c1-12(9-13-5-3-2-4-6-13)10-17-18(27)26-19(28-17)25-16-8-7-14(21)11-15(16)20(22,23)24/h2-11H,1H3,(H,25,26,27)/b12-9+,17-10-
InChIKey IXPCPCNUBMTCOP-YZXVBUGESA-N
Mol Weight 422.85 g/mol
Molecular Formula C20H14ClF3N2OS
Exact Mass 422.046746 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 71c6e7l7i3t
Name (5Z)-2-[4-chloro-2-(trifluoromethyl)anilino]-5-[(2E)-2-methyl-3-phenyl-2-propenylidene]-1,3-thiazol-4(5H)-one
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/C20H14ClF3N2OS/c1-12(9-13-5-3-2-4-6-13)10-17-18(27)26-19(28-17)25-16-8-7-14(21)11-15(16)20(22,23)24/h2-11H,1H3,(H,25,26,27)/b12-9+,17-10-
InChIKey IXPCPCNUBMTCOP-YZXVBUGESA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_28001
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: D77660; Labnumber: GORPS-135-5170; SBI_ID: SBI-028005
Synonyms 2-[4-chloro-2-(trifluoromethyl)anilino]-5-[2-methyl-3-phenyl-2-propenylidene]-1,3-thiazol-4(5H)-one
Temperature 318 °C