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4-Amino-3-[2-(3,4,5-trimethoxyphenyl)ethyl]-1,2,4-triazole-5-thione
SpectraBase Compound ID 61AxvbJzmzo
InChI InChI=1S/C13H18N4O3S/c1-18-9-6-8(7-10(19-2)12(9)20-3)4-5-11-15-16-13(21)17(11)14/h6-7H,4-5,14H2,1-3H3,(H,16,21)
InChIKey JBYKXZHBYKQHCY-UHFFFAOYSA-N
Mol Weight 310.37 g/mol
Molecular Formula C13H18N4O3S
Exact Mass 310.109962 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CLAfIE82iUs
Name 4-Amino-3-[2-(3,4,5-trimethoxyphenyl)ethyl]-1,2,4-triazole-5-thione
Comments Less than 3 mono-isotopic peaks
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Formula C13H18N4O3S
InChI InChI=1S/C13H18N4O3S/c1-18-9-6-8(7-10(19-2)12(9)20-3)4-5-11-15-16-13(21)17(11)14/h6-7H,4-5,14H2,1-3H3,(H,16,21)
InChIKey JBYKXZHBYKQHCY-UHFFFAOYSA-N
Molecular Weight 310.372 g/mol
SMILES N1N=C(N(C1=S)N)CCc1cc(OC)c(c(c1)OC)OC
SPLASH splash10-01q9-0905000000-c3e37d48e78dc484703a
Source of Spectrum F2-44-4535-4
Synonyms 4-azanyl-3-[2-(3,4,5-trimethoxyphenyl)ethyl]-1H-1,2,4-triazole-5-thione
Wiley ID 1705708