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(5Z)-3-ethyl-5-(4-methoxy-3-{[3-(trifluoromethyl)phenoxy]methyl}benzylidene)-2-thioxo-1,3-thiazolidin-4-one
SpectraBase Compound ID BSMa8PW3H0I
InChI InChI=1S/C21H18F3NO3S2/c1-3-25-19(26)18(30-20(25)29)10-13-7-8-17(27-2)14(9-13)12-28-16-6-4-5-15(11-16)21(22,23)24/h4-11H,3,12H2,1-2H3/b18-10-
InChIKey DGMVISRPERTJQP-ZDLGFXPLSA-N
Mol Weight 453.49 g/mol
Molecular Formula C21H18F3NO3S2
Exact Mass 453.06802 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9IS3t230iek
Name (5Z)-3-ethyl-5-(4-methoxy-3-{[3-(trifluoromethyl)phenoxy]methyl}benzylidene)-2-thioxo-1,3-thiazolidin-4-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/C21H18F3NO3S2/c1-3-25-19(26)18(30-20(25)29)10-13-7-8-17(27-2)14(9-13)12-28-16-6-4-5-15(11-16)21(22,23)24/h4-11H,3,12H2,1-2H3/b18-10-
InChIKey DGMVISRPERTJQP-ZDLGFXPLSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_6177
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/1023875; Labnumber: COL1031; UZI_ID: UZI-006179
Synonyms 3-ethyl-5-(4-methoxy-3-{[3-(trifluoromethyl)phenoxy]methyl}benzylidene)-2-thioxo-1,3-thiazolidin-4-one
Temperature 318 °C