For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
(5E)-5-[4-(benzyloxy)-3-methoxybenzylidene]-1-[2-(4-fluorophenyl)ethyl]-2,4,6(1H,3H,5H)-pyrimidinetrione
SpectraBase Compound ID Il4vjTfYJ1R
InChI InChI=1S/C27H23FN2O5/c1-34-24-16-20(9-12-23(24)35-17-19-5-3-2-4-6-19)15-22-25(31)29-27(33)30(26(22)32)14-13-18-7-10-21(28)11-8-18/h2-12,15-16H,13-14,17H2,1H3,(H,29,31,33)/b22-15+
InChIKey RTYSHOIAPNKYLB-PXLXIMEGSA-N
Mol Weight 474.49 g/mol
Molecular Formula C27H23FN2O5
Exact Mass 474.1591 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID Js8KJRyJd2n
Name (5E)-5-[4-(Benzyloxy)-3-methoxybenzylidene]-1-[2-(4-fluorophenyl)ethyl]-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 474.159100007 u
Formula C27H23FN2O5
InChI InChI=1S/C27H23FN2O5/c1-34-24-16-20(9-12-23(24)35-17-19-5-3-2-4-6-19)15-22-25(31)29-27(33)30(26(22)32)14-13-18-7-10-21(28)11-8-18/h2-12,15-16H,13-14,17H2,1H3,(H,29,31,33)/b22-15+
InChIKey RTYSHOIAPNKYLB-PXLXIMEGSA-N
Molecular Weight 474.488 g/mol
SMILES N1C(\C(C(N(C1=O)CCC1=CC=C(C=C1)F)=O)=C\C1=CC(OC)=C(C=C1)OCC1=CC=CC=C1)=O