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1H-1,2,4-Triazol-3-amine, 5-[(1-phenylethyl)thio]-
SpectraBase Compound ID C7oMgm0Wk1n
InChI InChI=1S/C10H12N4S/c1-7(8-5-3-2-4-6-8)15-10-12-9(11)13-14-10/h2-7H,1H3,(H3,11,12,13,14)
InChIKey ILSYMZNTRXPBCW-UHFFFAOYSA-N
Mol Weight 220.29 g/mol
Molecular Formula C10H12N4S
Exact Mass 220.078268 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JVdxFnS66a1
Name 1H-1,2,4-Triazol-3-amine, 5-[(1-phenylethyl)thio]-
Alternate Name(s) 5-((1-Phenylethyl)thio)-1H-1,2,4-triazol-3-amine 5-[(1-Phenylethyl)sulfanyl]-1H-1,2,4-triazol-3-amine 3-(1-Phenylethylthio)-1H-1,2,4-triazol-5-amine 3-(1-Phenylethylsulfanyl)-1H-1,2,4-triazol-5-amine
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Formula C10H12N4S
InChI InChI=1S/C10H12N4S/c1-7(8-5-3-2-4-6-8)15-10-12-9(11)13-14-10/h2-7H,1H3,(H3,11,12,13,14)
InChIKey ILSYMZNTRXPBCW-UHFFFAOYSA-N
Molecular Weight 220.294 g/mol
SMILES Nc1nc(SC(C)c2ccccc2)[nH]n1
SPLASH splash10-066r-2900000000-1334b6ebd78f8c594bbf
Source of Spectrum JX-2015-0-421
Wiley ID 1720368