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(4E)-2-(1,3-benzothiazol-2-yl)-4-[1-(5-chloro-2-hydroxyanilino)ethylidene]-5-(trifluoromethyl)-2,4-dihydro-3H-pyrazol-3-one

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(4E)-2-(1,3-benzothiazol-2-yl)-4-[1-(5-chloro-2-hydroxyanilino)ethylidene]-5-(trifluoromethyl)-2,4-dihydro-3H-pyrazol-3-one
SpectraBase Compound ID 5kBsin0qIYA
InChI InChI=1S/C19H12ClF3N4O2S/c1-9(24-12-8-10(20)6-7-13(12)28)15-16(19(21,22)23)26-27(17(15)29)18-25-11-4-2-3-5-14(11)30-18/h2-8,24,28H,1H3/b15-9+
InChIKey LGAPWJJRDJCOSU-OQLLNIDSSA-N
Mol Weight 452.84 g/mol
Molecular Formula C19H12ClF3N4O2S
Exact Mass 452.032159 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Fdpdw7WRZnZ
Name (4E)-2-(1,3-benzothiazol-2-yl)-4-[1-(5-chloro-2-hydroxyanilino)ethylidene]-5-(trifluoromethyl)-2,4-dihydro-3H-pyrazol-3-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/C19H12ClF3N4O2S/c1-9(24-12-8-10(20)6-7-13(12)28)15-16(19(21,22)23)26-27(17(15)29)18-25-11-4-2-3-5-14(11)30-18/h2-8,24,28H,1H3/b15-9+
InChIKey LGAPWJJRDJCOSU-OQLLNIDSSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_2978
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: UZI/8076426; UBI_ID: UBI-002979
Synonyms 2-(1,3-benzothiazol-2-yl)-4-[1-(5-chloro-2-hydroxyanilino)ethylidene]-5-(trifluoromethyl)-2,4-dihydro-3H-pyrazol-3-one
Temperature 308 °C