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5-(4-(4-Methoxybutoxy)benzyl)pyrimidine-2,4,6(1H,3H,5H)-trione
SpectraBase Compound ID A890i2mfgIe
InChI InChI=1S/C16H20N2O5/c1-22-8-2-3-9-23-12-6-4-11(5-7-12)10-13-14(19)17-16(21)18-15(13)20/h4-7,13H,2-3,8-10H2,1H3,(H2,17,18,19,20,21)
InChIKey XEUKBYMBNGMAOY-UHFFFAOYSA-N
Mol Weight 320.34 g/mol
Molecular Formula C16H20N2O5
Exact Mass 320.137222 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID G1sBOd5Oggb
Name 5-(4-(4-Methoxybutoxy)benzyl)pyrimidine-2,4,6(1H,3H,5H)-trione
Alternate Name(s) 5-[[4-(4-methoxybutoxy)phenyl]methyl]hexahydropyrimidine-2,4,6-trione 5-[[4-(4-methoxybutoxy)phenyl]methyl]-1,3-diazinane-2,4,6-trione
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Formula C16H20N2O5
InChI InChI=1S/C16H20N2O5/c1-22-8-2-3-9-23-12-6-4-11(5-7-12)10-13-14(19)17-16(21)18-15(13)20/h4-7,13H,2-3,8-10H2,1H3,(H2,17,18,19,20,21)
InChIKey XEUKBYMBNGMAOY-UHFFFAOYSA-N
Molecular Weight 320.345 g/mol
SMILES N1C(NC(=O)C(C1=O)Cc1ccc(cc1)OCCCCOC)=O
SPLASH splash10-000i-9322000000-c1a0ec3c0f33dd003bbb
Source of Spectrum F2-44-4241-3f
Wiley ID 1706014