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4,6-Dimethyl-2-(4-nitrophenyl)pyrimidine 1-oxide
SpectraBase Compound ID Jqp3qZ2QWIV
InChI InChI=1S/C12H11N3O3/c1-8-7-9(2)14(16)12(13-8)10-3-5-11(6-4-10)15(17)18/h3-7H,1-2H3
InChIKey NVIALRFBVXUPBD-UHFFFAOYSA-N
Mol Weight 245.24 g/mol
Molecular Formula C12H11N3O3
Exact Mass 245.080041 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9hzo6pHvQtQ
Name 4,6-Dimethyl-2-(4-nitrophenyl)pyrimidine 1-oxide
Comments Less than 3 mono-isotopic peaks
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Formula C12H11N3O3
InChI InChI=1S/C12H11N3O3/c1-8-7-9(2)14(16)12(13-8)10-3-5-11(6-4-10)15(17)18/h3-7H,1-2H3
InChIKey NVIALRFBVXUPBD-UHFFFAOYSA-N
Molecular Weight 245.238 g/mol
SMILES c1([n+](c(cc(n1)C)C)[O-])-c1ccc(N(=O)=O)cc1
SPLASH splash10-0005-1090000000-8bbf0f2680f1f6172f9d
Source of Spectrum H1-48-971-6
Synonyms 4,6-dimethyl-2-(4-nitrophenyl)-1-oxidanidyl-pyrimidin-1-ium 4,6-dimethyl-2-(4-nitrophenyl)-1-oxido-pyrimidin-1-ium
Wiley ID 816443