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2-keto-6-methyl-4-(3-nitrophenyl)-3,4-dihydro-1H-pyrimidine-5-carboxylic acid methyl ester
SpectraBase Compound ID JPov5bKZ8NS
InChI InChI=1S/C13H13N3O5/c1-7-10(12(17)21-2)11(15-13(18)14-7)8-4-3-5-9(6-8)16(19)20/h3-6,11H,1-2H3,(H2,14,15,18)
InChIKey VMFSQYFNNBSXEW-UHFFFAOYSA-N
Mol Weight 291.26 g/mol
Molecular Formula C13H13N3O5
Exact Mass 291.085521 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 92NMEpX0RqL
Name 2-keto-6-methyl-4-(3-nitrophenyl)-3,4-dihydro-1H-pyrimidine-5-carboxylic acid methyl ester
Alternate Name(s) 6-Methyl-4-(3-nitrophenyl)-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid methyl ester Methyl 6-methyl-4-(3-nitrophenyl)-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Methyl 6-methyl-4-(3-nitrophenyl)-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate
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Formula C13H13N3O5
InChI InChI=1S/C13H13N3O5/c1-7-10(12(17)21-2)11(15-13(18)14-7)8-4-3-5-9(6-8)16(19)20/h3-6,11H,1-2H3,(H2,14,15,18)
InChIKey VMFSQYFNNBSXEW-UHFFFAOYSA-N
Molecular Weight 291.263 g/mol
SMILES N1C(NC(=C(C1c1cc(N(=O)=O)ccc1)C(=O)OC)C)=O
SPLASH splash10-00no-3980000000-e05827c84de5356352b1
Source of Spectrum MZ-34-3014-4
Wiley ID 1582560