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(5Z)-5-(3,4-dimethoxybenzylidene)-2-{4-[3-(trifluoromethyl)phenyl]-1-piperazinyl}-1,3-thiazol-4(5H)-one
SpectraBase Compound ID C3anBhG9RBw
InChI InChI=1S/C23H22F3N3O3S/c1-31-18-7-6-15(12-19(18)32-2)13-20-21(30)27-22(33-20)29-10-8-28(9-11-29)17-5-3-4-16(14-17)23(24,25)26/h3-7,12-14H,8-11H2,1-2H3/b20-13-
InChIKey BKSQMAOUEKUQDM-MOSHPQCFSA-N
Mol Weight 477.5 g/mol
Molecular Formula C23H22F3N3O3S
Exact Mass 477.133397 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID JNW5f7v9w3P
Name (5Z)-5-(3,4-dimethoxybenzylidene)-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/C23H22F3N3O3S/c1-31-18-7-6-15(12-19(18)32-2)13-20-21(30)27-22(33-20)29-10-8-28(9-11-29)17-5-3-4-16(14-17)23(24,25)26/h3-7,12-14H,8-11H2,1-2H3/b20-13-
InChIKey BKSQMAOUEKUQDM-MOSHPQCFSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_12349
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: D71838; Labnumber: VLMK0194; SBI_ID: SBI-012352
Synonyms 5-(3,4-dimethoxybenzylidene)-2-{4-[3-(trifluoromethyl)phenyl]-1-piperazinyl}-1,3-thiazol-4(5H)-one
Temperature 308 °C