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Pyrimidine-2,4,6(1H,3H,5H)-trione, 5-[1-(2-diethylaminoethylamino)propylidene]-1-(4-methoxyphenyl)-
SpectraBase Compound ID IfC7A3yoxb
InChI InChI=1S/C20H28N4O4/c1-5-16(21-12-13-23(6-2)7-3)17-18(25)22-20(27)24(19(17)26)14-8-10-15(28-4)11-9-14/h8-11,21H,5-7,12-13H2,1-4H3,(H,22,25,27)/b17-16+
InChIKey LQQWRJYGNQPDOP-WUKNDPDISA-N
Mol Weight 388.47 g/mol
Molecular Formula C20H28N4O4
Exact Mass 388.211055 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 9MUPSjCMKsV
Name Pyrimidine-2,4,6(1H,3H,5H)-trione, 5-[1-(2-diethylaminoethylamino)propylidene]-1-(4-methoxyphenyl)-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 388.211055394 u
Formula C20H28N4O4
InChI InChI=1S/C20H28N4O4/c1-5-16(21-12-13-23(6-2)7-3)17-18(25)22-20(27)24(19(17)26)14-8-10-15(28-4)11-9-14/h8-11,21H,5-7,12-13H2,1-4H3,(H,22,25,27)/b17-16+
InChIKey LQQWRJYGNQPDOP-WUKNDPDISA-N
Molecular Weight 388.468 g/mol
SMILES CCN(CC)CCN\C(=C\1C(N(C(NC1=O)=O)C1=CC=C(OC)C=C1)=O)CC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.804148