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2-AMINO-6-(4-CYANOANILINO)-METHYL-1,7-DIMETHYLPTERIDIN-4(1H)-IMINE

View entire compound with spectra: 1 NMR, and 1 MS (GC)

2-AMINO-6-(4-CYANOANILINO)-METHYL-1,7-DIMETHYLPTERIDIN-4(1H)-IMINE
SpectraBase Compound ID 1sQlo5QDM1I
InChI InChI=1S/C16H16N8/c1-9-12(8-20-11-5-3-10(7-17)4-6-11)22-13-14(18)23-16(19)24(2)15(13)21-9/h3-6,20H,8H2,1-2H3,(H3,18,19,23)
InChIKey BQQAQQTZVDODFO-UHFFFAOYSA-N
Mol Weight 320.36 g/mol
Molecular Formula C16H16N8
Exact Mass 320.149793 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2XUb9ZcxDof
Name 4-[(4-amino-2-imino-1,7-dimethyl-6-pteridinyl)methylamino]benzonitrile
Alternate Name(s) 4-[(4-amino-2-imino-1,7-dimethyl-pteridin-6-yl)methylamino]benzonitrile 4-[(4-azanyl-2-azanylidene-1,7-dimethyl-pteridin-6-yl)methylamino]benzenecarbonitrile
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Formula C16H16N8
InChI InChI=1S/C16H16N8/c1-9-12(8-20-11-5-3-10(7-17)4-6-11)22-13-14(18)23-16(19)24(2)15(13)21-9/h3-6,20H,8H2,1-2H3,(H3,18,19,23)
InChIKey BQQAQQTZVDODFO-UHFFFAOYSA-N
Molecular Weight 320.360 g/mol
SMILES NC=1N(c2nc(c(CNc3ccc(C#N)cc3)nc2C(N1)=N)C)C
SPLASH splash10-0fk9-0695000000-895d8f31a3a609ca8a7a
Source of Spectrum Y-34-979-11
Wiley ID 1319903