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(5E)-5-[4-(benzyloxy)benzylidene]-1-(4-fluorobenzyl)-2,4,6(1H,3H,5H)-pyrimidinetrione

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(5E)-5-[4-(benzyloxy)benzylidene]-1-(4-fluorobenzyl)-2,4,6(1H,3H,5H)-pyrimidinetrione
SpectraBase Compound ID Ga2XLxnuaXv
InChI InChI=1S/C25H19FN2O4/c26-20-10-6-18(7-11-20)15-28-24(30)22(23(29)27-25(28)31)14-17-8-12-21(13-9-17)32-16-19-4-2-1-3-5-19/h1-14H,15-16H2,(H,27,29,31)/b22-14+
InChIKey GXBPWSJCWMGQNR-HYARGMPZSA-N
Mol Weight 430.44 g/mol
Molecular Formula C25H19FN2O4
Exact Mass 430.132885 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Do5wC7JimFW
Name (5E)-5-[4-(Benzyloxy)benzylidene]-1-(4-fluorobenzyl)-2,4,6(1H,3H,5H)-pyrimidinetrione
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 430.132885259 u
Formula C25H19FN2O4
InChI InChI=1S/C25H19FN2O4/c26-20-10-6-18(7-11-20)15-28-24(30)22(23(29)27-25(28)31)14-17-8-12-21(13-9-17)32-16-19-4-2-1-3-5-19/h1-14H,15-16H2,(H,27,29,31)/b22-14+
InChIKey GXBPWSJCWMGQNR-HYARGMPZSA-N
Molecular Weight 430.435 g/mol
SMILES N1C(\C(C(N(C1=O)CC1=CC=C(C=C1)F)=O)=C\C1=CC=C(OCC2=CC=CC=C2)C=C1)=O