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5,5-bis[4-(dimethylamino)benzyl]barbituric acid
SpectraBase Compound ID 1uQCiDAQtqN
InChI InChI=1S/C22H26N4O3/c1-25(2)17-9-5-15(6-10-17)13-22(19(27)23-21(29)24-20(22)28)14-16-7-11-18(12-8-16)26(3)4/h5-12H,13-14H2,1-4H3,(H2,23,24,27,28,29)
InChIKey FIZNQJNNOYRRDE-UHFFFAOYSA-N
Mol Weight 394.48 g/mol
Molecular Formula C22H26N4O3
Exact Mass 394.200491 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ka8pMZXfHf
Name 5,5-bis[4-(dimethylamino)benzyl]barbituric acid
Alternate Name(s) rec-5,5-Di(4-dimethylaminobenzyl)barbituric acid 5,5-bis[[4-(dimethylamino)phenyl]methyl]hexahydropyrimidine-2,4,6-trione 5,5-bis[[4-(dimethylamino)phenyl]methyl]-1,3-diazinane-2,4,6-trione
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Formula C22H26N4O3
InChI InChI=1S/C22H26N4O3/c1-25(2)17-9-5-15(6-10-17)13-22(19(27)23-21(29)24-20(22)28)14-16-7-11-18(12-8-16)26(3)4/h5-12H,13-14H2,1-4H3,(H2,23,24,27,28,29)
InChIKey FIZNQJNNOYRRDE-UHFFFAOYSA-N
Molecular Weight 394.475 g/mol
SMILES N1C(C(C(NC1=O)=O)(Cc1ccc(cc1)N(C)C)Cc1ccc(cc1)N(C)C)=O
SPLASH splash10-001i-0915000000-c9d7c7bd7d9342a321d2
Source of Spectrum AT-42-4107-0
Wiley ID 855095