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(5Z)-5-(2-chlorobenzylidene)-2-{4-[3-(trifluoromethyl)phenyl]-1-piperazinyl}-1,3-thiazol-4(5H)-one
SpectraBase Compound ID 3yif0b46LJP
InChI InChI=1S/C21H17ClF3N3OS/c22-17-7-2-1-4-14(17)12-18-19(29)26-20(30-18)28-10-8-27(9-11-28)16-6-3-5-15(13-16)21(23,24)25/h1-7,12-13H,8-11H2/b18-12-
InChIKey DLGDWVXARIJEEC-PDGQHHTCSA-N
Mol Weight 451.9 g/mol
Molecular Formula C21H17ClF3N3OS
Exact Mass 451.073296 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID CbQmHKxNJZr
Name (5Z)-5-(2-chlorobenzylidene)-2-{4-[3-(trifluoromethyl)phenyl]-1-piperazinyl}-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/C21H17ClF3N3OS/c22-17-7-2-1-4-14(17)12-18-19(29)26-20(30-18)28-10-8-27(9-11-28)16-6-3-5-15(13-16)21(23,24)25/h1-7,12-13H,8-11H2/b18-12-
InChIKey DLGDWVXARIJEEC-PDGQHHTCSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_17291
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: D26222; Labnumber: VLMK0092; SBI_ID: SBI-017294
Synonyms 5-(2-chlorobenzylidene)-2-{4-[3-(trifluoromethyl)phenyl]-1-piperazinyl}-1,3-thiazol-4(5H)-one
Temperature 318 °C