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2,4,6(1H,3H,5H)-pyrimidinetrione, 5-[[(2-aminophenyl)amino]methylene]-1-[3-(trifluoromethyl)phenyl]-, (5E)-
SpectraBase Compound ID CPhWiBxU8kS
InChI InChI=1S/C18H13F3N4O3/c19-18(20,21)10-4-3-5-11(8-10)25-16(27)12(15(26)24-17(25)28)9-23-14-7-2-1-6-13(14)22/h1-9,23H,22H2,(H,24,26,28)/b12-9+
InChIKey PKKFCRIDBULBQK-FMIVXFBMSA-N
Mol Weight 390.32 g/mol
Molecular Formula C18H13F3N4O3
Exact Mass 390.093975 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1IuNphHvEh6
Name 2,4,6(1H,3H,5H)-pyrimidinetrione, 5-[[(2-aminophenyl)amino]methylene]-1-[3-(trifluoromethyl)phenyl]-, (5E)-
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/C18H13F3N4O3/c19-18(20,21)10-4-3-5-11(8-10)25-16(27)12(15(26)24-17(25)28)9-23-14-7-2-1-6-13(14)22/h1-9,23H,22H2,(H,24,26,28)/b12-9+
InChIKey PKKFCRIDBULBQK-FMIVXFBMSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB3_9000_4875
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/12211132; Labnumber: LP-1709113