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N(4)-(o-toluoyl)-cytosine
SpectraBase Compound ID CaKqSacdzFu
InChI InChI=1S/C12H11N3O2/c1-8-4-2-3-5-9(8)11(16)14-10-6-7-13-12(17)15-10/h2-7H,1H3,(H2,13,14,15,16,17)
InChIKey RSCDYMIRBROPFY-UHFFFAOYSA-N
Mol Weight 229.24 g/mol
Molecular Formula C12H11N3O2
Exact Mass 229.085127 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3byo361iNrq
Name N(4)-(o-toluoyl)-cytosine
Alternate Name(s) 2-Methyl-N-(2-oxo-2,3-dihydro-4-pyrimidinyl)benzamide N-(1',2'-Dihydro-2'-oxopyrimidin-4'-yl)-2-methylbenzamide
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Formula C12H11N3O2
InChI InChI=1S/C12H11N3O2/c1-8-4-2-3-5-9(8)11(16)14-10-6-7-13-12(17)15-10/h2-7H,1H3,(H2,13,14,15,16,17)
InChIKey RSCDYMIRBROPFY-UHFFFAOYSA-N
Molecular Weight 229.239 g/mol
SMILES N1C(NC(c2c(cccc2)C)=O)=CC=NC1=O
SPLASH splash10-00kf-9660000000-07da78055d59621d4a32
Source of Spectrum H-86-2951-13
Wiley ID 1525621