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N-(4-chlorophenyl)-N'-{2-[2-nitro-4-(trifluoromethyl)anilino]ethyl}thiourea
SpectraBase Compound ID AKkWf6W5xIi
InChI InChI=1S/C16H14ClF3N4O2S/c17-11-2-4-12(5-3-11)23-15(27)22-8-7-21-13-6-1-10(16(18,19)20)9-14(13)24(25)26/h1-6,9,21H,7-8H2,(H2,22,23,27)
InChIKey GEAZKGMRRIJGPK-UHFFFAOYSA-N
Mol Weight 418.82 g/mol
Molecular Formula C16H14ClF3N4O2S
Exact Mass 418.047809 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID ETrABwVW5My
Name N-(4-chlorophenyl)-N'-{2-[2-nitro-4-(trifluoromethyl)anilino]ethyl}thiourea
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/C16H14ClF3N4O2S/c17-11-2-4-12(5-3-11)23-15(27)22-8-7-21-13-6-1-10(16(18,19)20)9-14(13)24(25)26/h1-6,9,21H,7-8H2,(H2,22,23,27)
InChIKey GEAZKGMRRIJGPK-UHFFFAOYSA-N
NMR Offset 15.0036
NMR Spectrometer Frequency 250.134
Observed nucleus 1H
Origin 1H_ASIOH_7529_2107
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: NMR/9302204; Labnumber: PE-0009938
Temperature 297 °C