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5-(benzylthio)-4H-1,2,4-triazol-3-amine
SpectraBase Compound ID EUniGmZC324
InChI InChI=1S/C9H10N4S/c10-8-11-9(13-12-8)14-6-7-4-2-1-3-5-7/h1-5H,6H2,(H3,10,11,12,13)
InChIKey NQJATJCXKYZVEL-UHFFFAOYSA-N
Mol Weight 206.27 g/mol
Molecular Formula C9H10N4S
Exact Mass 206.062618 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JtlprVeVeOI
Name 5-(benzylthio)-4H-1,2,4-triazol-3-amine
Alternate Name(s) 5-(benzylsulfanyl)-4H-1,2,4-triazol-3-amine 3-(Phenylmethylthio)-1H-1,2,4-triazol-5-amine 3-Benzylsulfanyl-1H-1,2,4-triazol-5-amine 3-(Phenylmethylsulfanyl)-1H-1,2,4-triazol-5-amine
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Formula C9H10N4S
InChI InChI=1S/C9H10N4S/c10-8-11-9(13-12-8)14-6-7-4-2-1-3-5-7/h1-5H,6H2,(H3,10,11,12,13)
InChIKey NQJATJCXKYZVEL-UHFFFAOYSA-N
Molecular Weight 206.267 g/mol
SMILES Nc1nnc(SCc2ccccc2)[nH]1
SPLASH splash10-0006-9120000000-fe2d885cf8eac29da9fd
Source of Spectrum JX-2015-5-821
Wiley ID 1727571