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4-Amino-5-[(3,4,5-trimethoxyphenyl)methyl]-4H-1,2,4-triazole-3-thiol
SpectraBase Compound ID KyhrutLz6QK
InChI InChI=1S/C12H16N4O3S/c1-17-8-4-7(5-9(18-2)11(8)19-3)6-10-14-15-12(20)16(10)13/h4-5H,6,13H2,1-3H3,(H,15,20)
InChIKey VTLIMEWWILDQSY-UHFFFAOYSA-N
Mol Weight 296.34 g/mol
Molecular Formula C12H16N4O3S
Exact Mass 296.094312 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Azdlq4aYdLU
Name 4-Amino-3-(3,4,5-trimethoxyphenylmethyl)-1,2,4-triazole-5-thione
Alternate Name(s) 4-Amino-3-[(3,4,5-trimethoxyphenyl)methyl]-1H-1,2,4-triazole-5-thione 4-Azanyl-3-[(3,4,5-trimethoxyphenyl)methyl]-1H-1,2,4-triazole-5-thione
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Formula C12H16N4O3S
InChI InChI=1S/C12H16N4O3S/c1-17-8-4-7(5-9(18-2)11(8)19-3)6-10-14-15-12(20)16(10)13/h4-5H,6,13H2,1-3H3,(H,15,20)
InChIKey VTLIMEWWILDQSY-UHFFFAOYSA-N
Molecular Weight 296.345 g/mol
SMILES N1N=C(N(C1=S)N)Cc1cc(OC)c(c(c1)OC)OC
SPLASH splash10-000t-0090000000-0db593610db83d7ac8f5
Source of Spectrum F2-44-4535-3
Wiley ID 1705709