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7-(1-methyl-1H-indol-3-yl)-5-oxo-2-phenyl-4,5-dihydro-2H-1,2,3-triazolo[4,5-b]pyridine-6-carbonitrile
SpectraBase Compound ID KYx6ED8h726
InChI InChI=1S/C21H14N6O/c1-26-12-16(14-9-5-6-10-17(14)26)18-15(11-22)21(28)23-20-19(18)24-27(25-20)13-7-3-2-4-8-13/h2-10,12H,1H3,(H,23,25,28)
InChIKey MNAJGOSOQOKISF-UHFFFAOYSA-N
Mol Weight 366.38 g/mol
Molecular Formula C21H14N6O
Exact Mass 366.122909 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LIzW0C8SAbf
Name 7-(1-methyl-1H-indol-3-yl)-5-oxo-2-phenyl-4,5-dihydro-2H-1,2,3-triazolo[4,5-b]pyridine-6-carbonitrile
Comments Less than 3 mono-isotopic peaks
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Formula C21H14N6O
InChI InChI=1S/C21H14N6O/c1-26-12-16(14-9-5-6-10-17(14)26)18-15(11-22)21(28)23-20-19(18)24-27(25-20)13-7-3-2-4-8-13/h2-10,12H,1H3,(H,23,25,28)
InChIKey MNAJGOSOQOKISF-UHFFFAOYSA-N
Molecular Weight 366.384 g/mol
SMILES N1C(C(=C(c2c1n[n](n2)-c1ccccc1)c1c[n](C)c2c1cccc2)C#N)=O
SPLASH splash10-014i-0009000000-b5b038508517a271fd4a
Source of Spectrum F2-46-1818-12a
Synonyms 7-(1-methyl-3-indolyl)-5-oxo-2-phenyl-3H-triazolo[4,5-b]pyridine-6-carbonitrile 7-(1-methylindol-3-yl)-5-oxo-2-phenyl-3H-triazolo[4,5-b]pyridine-6-carbonitrile 7-(1-methylindol-3-yl)-5-oxidanylidene-2-phenyl-3H-[1,2,3]triazolo[4,5-b]pyridine-6-carbonitrile
Wiley ID 1703987