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5-(1,3-benzodioxol-5-yl)-6-methyl-pyrimidine-2,4-diamine
SpectraBase Compound ID Cr66vs2rGPe
InChI InChI=1S/C12H12N4O2/c1-6-10(11(13)16-12(14)15-6)7-2-3-8-9(4-7)18-5-17-8/h2-4H,5H2,1H3,(H4,13,14,15,16)
InChIKey MSBCGUFXGLKYLJ-UHFFFAOYSA-N
Mol Weight 244.25 g/mol
Molecular Formula C12H12N4O2
Exact Mass 244.096026 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7dlQJWPCRg3
Name 5-(1,3-benzodioxol-5-yl)-6-methyl-pyrimidine-2,4-diamine
Comments Less than 3 mono-isotopic peaks
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Formula C12H12N4O2
InChI InChI=1S/C12H12N4O2/c1-6-10(11(13)16-12(14)15-6)7-2-3-8-9(4-7)18-5-17-8/h2-4H,5H2,1H3,(H4,13,14,15,16)
InChIKey MSBCGUFXGLKYLJ-UHFFFAOYSA-N
Molecular Weight 244.254 g/mol
SMILES Nc1nc(c(c(n1)C)-c1cc2OCOc2cc1)N
SPLASH splash10-0006-0090000000-0aa2fbe4cbc4f41a95d8
Source of Spectrum JA-49-647-0
Synonyms [2-amino-5-(1,3-benzodioxol-5-yl)-6-methyl-pyrimidin-4-yl]amine
Wiley ID 1246757