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(5Z)-2-[4-chloro-2-(trifluoromethyl)anilino]-5-(4-ethoxy-3-methoxybenzylidene)-1,3-thiazol-4(5H)-one
SpectraBase Compound ID C1jJPOcKe2L
InChI InChI=1S/C20H16ClF3N2O3S/c1-3-29-15-7-4-11(8-16(15)28-2)9-17-18(27)26-19(30-17)25-14-6-5-12(21)10-13(14)20(22,23)24/h4-10H,3H2,1-2H3,(H,25,26,27)/b17-9-
InChIKey XUWNLUAKGMLUOH-MFOYZWKCSA-N
Mol Weight 456.87 g/mol
Molecular Formula C20H16ClF3N2O3S
Exact Mass 456.052226 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID GfFULPc22sj
Name (5Z)-2-[4-chloro-2-(trifluoromethyl)anilino]-5-(4-ethoxy-3-methoxybenzylidene)-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/C20H16ClF3N2O3S/c1-3-29-15-7-4-11(8-16(15)28-2)9-17-18(27)26-19(30-17)25-14-6-5-12(21)10-13(14)20(22,23)24/h4-10H,3H2,1-2H3,(H,25,26,27)/b17-9-
InChIKey XUWNLUAKGMLUOH-MFOYZWKCSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_26800
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: D67084; Labnumber: GORPS-135-5071; SBI_ID: SBI-026804
Synonyms 2-[4-chloro-2-(trifluoromethyl)anilino]-5-(4-ethoxy-3-methoxybenzylidene)-1,3-thiazol-4(5H)-one
Temperature 315 °C