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2-THIO-8-AZAXANTHIN
SpectraBase Compound ID BmgbATRIvYv
InChI InChI=1S/C4H3N5OS/c10-3-1-2(8-9-7-1)5-4(11)6-3/h(H3,5,6,7,8,9,10,11)
InChIKey YLORBLDFYRRZLA-UHFFFAOYSA-N
Mol Weight 169.16 g/mol
Molecular Formula C4H3N5OS
Exact Mass 169.005831 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ir5W7Z7DmAu
Name 5-Mercapto-1H-[1,2,3]triazolo[4,5-d]pyrimidin-7-ol
Alternate Name(s) 5-sulfanylidene-2,3-dihydrotriazolo[4,5-d]pyrimidin-7-one 5-sulfanylidene-2,3-dihydro-[1,2,3]triazolo[4,5-d]pyrimidin-7-one
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Formula C4H3N5OS
InChI InChI=1S/C4H3N5OS/c10-3-1-2(8-9-7-1)5-4(11)6-3/h(H3,5,6,7,8,9,10,11)
InChIKey YLORBLDFYRRZLA-UHFFFAOYSA-N
Molecular Weight 169.162 g/mol
SMILES Oc1nc(nc2nn[nH]c12)S
SPLASH splash10-0j4i-7900000000-f672007338a129758aa0
Source of Spectrum JX-2012-425
Wiley ID 1660872