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thiourea, N-(4-methoxyphenyl)-N'-[2-[[2-nitro-4-(trifluoromethyl)phenyl]amino]ethyl]-
SpectraBase Compound ID 6rRKRxtDIDb
InChI InChI=1S/C17H17F3N4O3S/c1-27-13-5-3-12(4-6-13)23-16(28)22-9-8-21-14-7-2-11(17(18,19)20)10-15(14)24(25)26/h2-7,10,21H,8-9H2,1H3,(H2,22,23,28)
InChIKey UILWOCZANLGOGP-UHFFFAOYSA-N
Mol Weight 414.4 g/mol
Molecular Formula C17H17F3N4O3S
Exact Mass 414.097346 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5IMhwG3rZI8
Name thiourea, N-(4-methoxyphenyl)-N'-[2-[[2-nitro-4-(trifluoromethyl)phenyl]amino]ethyl]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 414.097346083 u
Formula C17H17F3N4O3S
InChI InChI=1S/C17H17F3N4O3S/c1-27-13-5-3-12(4-6-13)23-16(28)22-9-8-21-14-7-2-11(17(18,19)20)10-15(14)24(25)26/h2-7,10,21H,8-9H2,1H3,(H2,22,23,28)
InChIKey UILWOCZANLGOGP-UHFFFAOYSA-N
Molecular Weight 414.403 g/mol
NMR Offset 17.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_8603
Solvent DMSO-d6
Source Vendor ID: NMR/10210282; Lab Info: PE; Lab Number: PE-0790110