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4-Amino-5-[(pyridin-4-ylmethyl)sulfanyl]-4H-1,2,4-triazole-3-thiol
SpectraBase Compound ID 7TlSNInIhNr
InChI InChI=1S/C8H9N5S2/c9-13-7(14)11-12-8(13)15-5-6-1-3-10-4-2-6/h1-4H,5,9H2,(H,11,14)
InChIKey SDCCFGGMUIOZJZ-UHFFFAOYSA-N
Mol Weight 239.32 g/mol
Molecular Formula C8H9N5S2
Exact Mass 239.029938 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2RZlJZSKlU
Name 4-Amino-5-[(pyridin-4-ylmethyl)sulfanyl]-4H-1,2,4-triazole-3-thiol
Alternate Name(s) Hydrosulfide, [4-amino-5-[(4-pyridinylmethyl)thio]-4H-1,2,4-triazol-3-yl]- 4-Amino-3-(pyridin-4-ylmethylthio)-1H-1,2,4-triazole-5-thione 4-Amino-3-(pyridin-4-ylmethylsulfanyl)-1H-1,2,4-triazole-5-thione 4-Amino-3-(4-pyridylmethylsulfanyl)-1H-1,2,4-triazole-5-thione 4-Azanyl-3-(pyridin-4-ylmethylsulfanyl)-1H-1,2,4-triazole-5-thione
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Formula C8H9N5S2
InChI InChI=1S/C8H9N5S2/c9-13-7(14)11-12-8(13)15-5-6-1-3-10-4-2-6/h1-4H,5,9H2,(H,11,14)
InChIKey SDCCFGGMUIOZJZ-UHFFFAOYSA-N
Molecular Weight 239.315 g/mol
SMILES N[n]1c(nnc1S)SCc1ccncc1
SPLASH splash10-000f-9110000000-8707f5711408c3f83c94
Source of Spectrum IY-2-4889-8
Wiley ID 1656881