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(5Z)-5-(4-tert-butylbenzylidene)-2-{4-[3-(trifluoromethyl)phenyl]-1-piperazinyl}-1,3-thiazol-4(5H)-one
SpectraBase Compound ID 4WdTHXUrf8c
InChI InChI=1S/C25H26F3N3OS/c1-24(2,3)18-9-7-17(8-10-18)15-21-22(32)29-23(33-21)31-13-11-30(12-14-31)20-6-4-5-19(16-20)25(26,27)28/h4-10,15-16H,11-14H2,1-3H3/b21-15-
InChIKey PBIVAKNPOWSXKB-QNGOZBTKSA-N
Mol Weight 473.56 g/mol
Molecular Formula C25H26F3N3OS
Exact Mass 473.174868 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2UwFl6JSdqg
Name (5Z)-5-(4-tert-butylbenzylidene)-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/C25H26F3N3OS/c1-24(2,3)18-9-7-17(8-10-18)15-21-22(32)29-23(33-21)31-13-11-30(12-14-31)20-6-4-5-19(16-20)25(26,27)28/h4-10,15-16H,11-14H2,1-3H3/b21-15-
InChIKey PBIVAKNPOWSXKB-QNGOZBTKSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_9080
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: D52942; Labnumber: VLMK0166; SBI_ID: SBI-009083
Synonyms 5-(4-tert-butylbenzylidene)-2-{4-[3-(trifluoromethyl)phenyl]-1-piperazinyl}-1,3-thiazol-4(5H)-one
Temperature 318 °C