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4-keto-N-phenethyl-1H-[1,2,4]triazino[4,3-a]benzimidazole-3-carboxamide
SpectraBase Compound ID 8UgZdc99keB
InChI InChI=1S/C18H15N5O2/c24-16(19-11-10-12-6-2-1-3-7-12)15-17(25)23-14-9-5-4-8-13(14)20-18(23)22-21-15/h1-9H,10-11H2,(H,19,24)(H,20,22)
InChIKey XCNBYZUXAZOAOK-UHFFFAOYSA-N
Mol Weight 333.35 g/mol
Molecular Formula C18H15N5O2
Exact Mass 333.122575 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FsJe4RSoPZm
Name 4-keto-N-phenethyl-1H-[1,2,4]triazino[4,3-a]benzimidazole-3-carboxamide
Alternate Name(s) 4-oxo-N-(2-phenylethyl)-1H-[1,2,4]triazino[4,3-a]benzimidazole-3-carboxamide
Comments Less than 3 mono-isotopic peaks
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Formula C18H15N5O2
InChI InChI=1S/C18H15N5O2/c24-16(19-11-10-12-6-2-1-3-7-12)15-17(25)23-14-9-5-4-8-13(14)20-18(23)22-21-15/h1-9H,10-11H2,(H,19,24)(H,20,22)
InChIKey XCNBYZUXAZOAOK-UHFFFAOYSA-N
Molecular Weight 333.351 g/mol
SMILES N(C(C=1C(N2C(=NN1)Nc1c2cccc1)=O)=O)CCc1ccccc1
SPLASH splash10-03di-0091000000-2bca1261dc5eaa520c6b
Source of Spectrum D9-336-418-10
Wiley ID 1551090