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2-[(5-anilino-1H-1,2,4-triazol-3-yl)amino]ethanethiol
SpectraBase Compound ID HjLP2ObaVhp
InChI InChI=1S/C10H13N5S/c16-7-6-11-9-13-10(15-14-9)12-8-4-2-1-3-5-8/h1-5,16H,6-7H2,(H3,11,12,13,14,15)
InChIKey HXPPGUYIEGKTFN-UHFFFAOYSA-N
Mol Weight 235.31 g/mol
Molecular Formula C10H13N5S
Exact Mass 235.089167 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GpMTCZtu1nt
Name 2-[(5-anilino-1H-1,2,4-triazol-3-yl)amino]ethanethiol
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Formula C10H13N5S
InChI InChI=1S/C10H13N5S/c16-7-6-11-9-13-10(15-14-9)12-8-4-2-1-3-5-8/h1-5,16H,6-7H2,(H3,11,12,13,14,15)
InChIKey HXPPGUYIEGKTFN-UHFFFAOYSA-N
Molecular Weight 235.309 g/mol
SMILES [nH]1nc(nc1NCCS)Nc1ccccc1
SPLASH splash10-002r-3910000000-76724995e70a0b5274f8
Source of Spectrum SO-0-676-22
Synonyms 2-[(5-phenylazanyl-1H-1,2,4-triazol-3-yl)amino]ethanethiol
Wiley ID 1540996