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3-(benzylsulfanyl)-5-methyl-4H-1,2,4-triazol-4-amine
SpectraBase Compound ID JY8PuOUIs8c
InChI InChI=1S/C10H12N4S/c1-8-12-13-10(14(8)11)15-7-9-5-3-2-4-6-9/h2-6H,7,11H2,1H3
InChIKey DKIWOMYRUZFBCU-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 9FMOLRxG1It
Name 3-(benzylsulfanyl)-5-methyl-4H-1,2,4-triazol-4-amine
Alternate Name(s) 3-Benzylsulfanyl-5-methyl-1,2,4-triazol-4-amine 3-Methyl-5-(phenylmethylsulfanyl)-1,2,4-triazol-4-amine 3-Methyl-5-(phenylmethylthio)-1,2,4-triazol-4-amine [3-(benzylthio)-5-methyl-1,2,4-triazol-4-yl]amine
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Formula C10H12N4S
InChI InChI=1S/C10H12N4S/c1-8-12-13-10(14(8)11)15-7-9-5-3-2-4-6-9/h2-6H,7,11H2,1H3
InChIKey DKIWOMYRUZFBCU-UHFFFAOYSA-N
Molecular Weight 220.294 g/mol
SMILES N[n]1c(nnc1C)SCc1ccccc1
SPLASH splash10-0006-9420000000-3062e5caaaab2855fb28
Source of Spectrum K-2001-428-32
Wiley ID 1578533