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N-(4-{[(2E)-2-(3-nitrobenzylidene)hydrazino]carbonyl}phenyl)-N'-[3-(trifluoromethyl)phenyl]urea
SpectraBase Compound ID D5WEdJvfM2p
InChI InChI=1S/C22H16F3N5O4/c23-22(24,25)16-4-2-5-18(12-16)28-21(32)27-17-9-7-15(8-10-17)20(31)29-26-13-14-3-1-6-19(11-14)30(33)34/h1-13H,(H,29,31)(H2,27,28,32)/b26-13+
InChIKey QRSYAIFITPHDNI-LGJNPRDNSA-N
Mol Weight 471.4 g/mol
Molecular Formula C22H16F3N5O4
Exact Mass 471.115439 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID DZff6zcDPk9
Name N-(4-{[(2E)-2-(3-nitrobenzylidene)hydrazino]carbonyl}phenyl)-N'-[3-(trifluoromethyl)phenyl]urea
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/C22H16F3N5O4/c23-22(24,25)16-4-2-5-18(12-16)28-21(32)27-17-9-7-15(8-10-17)20(31)29-26-13-14-3-1-6-19(11-14)30(33)34/h1-13H,(H,29,31)(H2,27,28,32)/b26-13+
InChIKey QRSYAIFITPHDNI-LGJNPRDNSA-N
NMR Offset 17.1563
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_17962
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: 987/00006472; Labnumber: 987/00006472218879; VK_ID: VK-017969
Synonyms N-(4-{[2-(3-nitrobenzylidene)hydrazino]carbonyl}phenyl)-N'-[3-(trifluoromethyl)phenyl]urea
Temperature 308 °C