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(5Z)-1-benzyl-5-[1-(4-ethoxyanilino)ethylidene]-2,4,6(1H,3H,5H)-pyrimidinetrione
SpectraBase Compound ID DsVfhqEqJgd
InChI InChI=1S/C21H21N3O4/c1-3-28-17-11-9-16(10-12-17)22-14(2)18-19(25)23-21(27)24(20(18)26)13-15-7-5-4-6-8-15/h4-12,22H,3,13H2,1-2H3,(H,23,25,27)/b18-14-
InChIKey LIRJBVNKBMUDLC-JXAWBTAJSA-N
Mol Weight 379.42 g/mol
Molecular Formula C21H21N3O4
Exact Mass 379.153206 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2VeAv3R2Phw
Name (5Z)-1-Benzyl-5-[1-(4-ethoxyanilino)ethylidene]-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 379.153206164 u
Formula C21H21N3O4
InChI InChI=1S/C21H21N3O4/c1-3-28-17-11-9-16(10-12-17)22-14(2)18-19(25)23-21(27)24(20(18)26)13-15-7-5-4-6-8-15/h4-12,22H,3,13H2,1-2H3,(H,23,25,27)/b18-14-
InChIKey LIRJBVNKBMUDLC-JXAWBTAJSA-N
Molecular Weight 379.416 g/mol
SMILES N(\C(=C/1C(N(C(NC1=O)=O)CC=1C=CC=CC1)=O)C)C1=CC=C(C=C1)OCC