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(5E)-5-[4-(difluoromethoxy)benzylidene]-2-[4-(4-fluorobenzyl)-1-piperazinyl]-1,3-thiazol-4(5H)-one
SpectraBase Compound ID 4JKHGtdI9kE
InChI InChI=1S/C22H20F3N3O2S/c23-17-5-1-16(2-6-17)14-27-9-11-28(12-10-27)22-26-20(29)19(31-22)13-15-3-7-18(8-4-15)30-21(24)25/h1-8,13,21H,9-12,14H2/b19-13+
InChIKey IZRARXWSSDNCHD-CPNJWEJPSA-N
Mol Weight 447.48 g/mol
Molecular Formula C22H20F3N3O2S
Exact Mass 447.122833 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID BjLnwfGuE1q
Name (5E)-5-[4-(difluoromethoxy)benzylidene]-2-[4-(4-fluorobenzyl)-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/C22H20F3N3O2S/c23-17-5-1-16(2-6-17)14-27-9-11-28(12-10-27)22-26-20(29)19(31-22)13-15-3-7-18(8-4-15)30-21(24)25/h1-8,13,21H,9-12,14H2/b19-13+
InChIKey IZRARXWSSDNCHD-CPNJWEJPSA-N
NMR Offset 15.3209
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_34228
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: 2177050; SBI_ID: SBI-034232
Synonyms 5-[4-(difluoromethoxy)benzylidene]-2-[4-(4-fluorobenzyl)-1-piperazinyl]-1,3-thiazol-4(5H)-one
Temperature 297 °C