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2,4,6(1H,3H,5H)-pyrimidinetrione, 1-(4-bromo-3-methylphenyl)-5-[(4-fluorophenyl)methylene]-, (5E)-
SpectraBase Compound ID 9sdw30w7hMF
InChI InChI=1S/C18H12BrFN2O3/c1-10-8-13(6-7-15(10)19)22-17(24)14(16(23)21-18(22)25)9-11-2-4-12(20)5-3-11/h2-9H,1H3,(H,21,23,25)/b14-9+
InChIKey LNFXSWVPKDJALC-NTEUORMPSA-N
Mol Weight 403.21 g/mol
Molecular Formula C18H12BrFN2O3
Exact Mass 402.001533 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 592irWUXR1k
Name 2,4,6(1H,3H,5H)-pyrimidinetrione, 1-(4-bromo-3-methylphenyl)-5-[(4-fluorophenyl)methylene]-, (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/C18H12BrFN2O3/c1-10-8-13(6-7-15(10)19)22-17(24)14(16(23)21-18(22)25)9-11-2-4-12(20)5-3-11/h2-9H,1H3,(H,21,23,25)/b14-9+
InChIKey LNFXSWVPKDJALC-NTEUORMPSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB3_9000_6928
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/12228308