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(5Z)-2-[4-chloro-2-(trifluoromethyl)anilino]-5-(3-fluorobenzylidene)-1,3-thiazol-4(5H)-one
SpectraBase Compound ID 3VPUleMjawZ
InChI InChI=1S/C17H9ClF4N2OS/c18-10-4-5-13(12(8-10)17(20,21)22)23-16-24-15(25)14(26-16)7-9-2-1-3-11(19)6-9/h1-8H,(H,23,24,25)/b14-7-
InChIKey POLBIKLOFUFPCK-AUWJEWJLSA-N
Mol Weight 400.78 g/mol
Molecular Formula C17H9ClF4N2OS
Exact Mass 400.006024 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID EanLE4GIQsR
Name (5Z)-2-[4-chloro-2-(trifluoromethyl)anilino]-5-(3-fluorobenzylidene)-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/C17H9ClF4N2OS/c18-10-4-5-13(12(8-10)17(20,21)22)23-16-24-15(25)14(26-16)7-9-2-1-3-11(19)6-9/h1-8H,(H,23,24,25)/b14-7-
InChIKey POLBIKLOFUFPCK-AUWJEWJLSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_26792
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: D67075; Labnumber: GORPS-135-0623; SBI_ID: SBI-026796
Synonyms 2-[4-chloro-2-(trifluoromethyl)anilino]-5-(3-fluorobenzylidene)-1,3-thiazol-4(5H)-one
Temperature 315 °C