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4-methyl-N-((E)-2-[4-(methylsulfanyl)phenyl]-1-{[3-(trifluoromethyl)anilino]carbonyl}ethenyl)benzamide
SpectraBase Compound ID JLLVXQP3Ccm
InChI InChI=1S/C25H21F3N2O2S/c1-16-6-10-18(11-7-16)23(31)30-22(14-17-8-12-21(33-2)13-9-17)24(32)29-20-5-3-4-19(15-20)25(26,27)28/h3-15H,1-2H3,(H,29,32)(H,30,31)/b22-14+
InChIKey HRMORVRGQHKXES-HYARGMPZSA-N
Mol Weight 470.51 g/mol
Molecular Formula C25H21F3N2O2S
Exact Mass 470.127584 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID EAndEHtq8gx
Name 4-methyl-N-((E)-2-[4-(methylsulfanyl)phenyl]-1-{[3-(trifluoromethyl)anilino]carbonyl}ethenyl)benzamide
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/C25H21F3N2O2S/c1-16-6-10-18(11-7-16)23(31)30-22(14-17-8-12-21(33-2)13-9-17)24(32)29-20-5-3-4-19(15-20)25(26,27)28/h3-15H,1-2H3,(H,29,32)(H,30,31)/b22-14+
InChIKey HRMORVRGQHKXES-HYARGMPZSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_13255
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: 102292; Labnumber: RRHO-062; VK_ID: VK-013260
Synonyms 4-methyl-N-(2-[4-(methylsulfanyl)phenyl]-1-{[3-(trifluoromethyl)anilino]carbonyl}ethenyl)benzamide
Temperature 318 °C