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2-Methyl-8-oxo-4-phenyl-1,2,3,4,7,8,9,10-octahydro[1,2,4]triazolo[1,5-a:4,3-a']dipyrimidin-5-ium chloride
SpectraBase Compound ID HnBxJvM4RGt
InChI InChI=1S/C15H17N5O.ClH/c1-10-9-12(11-5-3-2-4-6-11)20-15(16-10)19-8-7-13(21)17-14(19)18-20;/h2-6,10,12H,7-9H2,1H3,(H,17,18,21);1H
InChIKey QNUJZHGUIBSDLV-UHFFFAOYSA-N
Mol Weight 319.8 g/mol
Molecular Formula C15H18ClN5O
Exact Mass 319.119988 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 233fka6dPab
Name 2-Methyl-8-oxo-4-phenyl-1,2,3,4,7,8,9,10-octahydro[1,2,4]triazolo[1,5-a:4,3-a']dipyrimidin-5-ium chloride
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Formula C15H18ClN5O
InChI InChI=1S/C15H17N5O.ClH/c1-10-9-12(11-5-3-2-4-6-11)20-15(16-10)19-8-7-13(21)17-14(19)18-20;/h2-6,10,12H,7-9H2,1H3,(H,17,18,21);1H
InChIKey QNUJZHGUIBSDLV-UHFFFAOYSA-N
Molecular Weight 319.796 g/mol
SMILES [Cl-].N1C(CC[n]2c1n[n+]1c2NC(CC1c1ccccc1)C)=O
SPLASH splash10-014i-0290000000-ddaccb02a10d3a9a8696
Source of Spectrum F-70-694-5d
Synonyms 2-Methyl-8-oxo-4-phenyl-1,2,3,4,7,8,9,10-octahydro-[1,2,4]triazolo[1,5-a:4,3-a']dipyrimidin-5-ium chloride
Wiley ID 1742578