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1,3,7-trimethyl-8-[(2E)-2-(p-tolylmethylene)hydrazino]purine-2,6-dione
SpectraBase Compound ID 6Gn6nxCenTO
InChI InChI=1S/C16H18N6O2/c1-10-5-7-11(8-6-10)9-17-19-15-18-13-12(20(15)2)14(23)22(4)16(24)21(13)3/h5-9H,1-4H3,(H,18,19)/b17-9+
InChIKey PKANYMRYFPNEHA-RQZCQDPDSA-N
Mol Weight 326.36 g/mol
Molecular Formula C16H18N6O2
Exact Mass 326.149124 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DvombQ82UDe
Name 1,3,7-trimethyl-8-[(2E)-2-(p-tolylmethylene)hydrazino]purine-2,6-dione
Alternate Name(s) 1,3,7-trimethyl-8-[(2E)-2-[(4-methylphenyl)methylidene]hydrazinyl]purine-2,6-dione 1,3,7-trimethyl-8-[(N'E)-N'-(4-methylbenzylidene)hydrazino]xanthine
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Formula C16H18N6O2
InChI InChI=1S/C16H18N6O2/c1-10-5-7-11(8-6-10)9-17-19-15-18-13-12(20(15)2)14(23)22(4)16(24)21(13)3/h5-9H,1-4H3,(H,18,19)/b17-9+
InChIKey PKANYMRYFPNEHA-RQZCQDPDSA-N
Molecular Weight 326.360 g/mol
SMILES N(c1nc2c(C(=O)N(C(N2C)=O)C)[n]1C)\N=C\c1ccc(cc1)C
SPLASH splash10-0a59-6294000000-bf3c0650fa538743c665
Source of Spectrum AH-134-569-7
Wiley ID 1546874