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3-tert-Butyl-7-(methylsulfanyl)-4H-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-4-one
SpectraBase Compound ID 9PGeqjILynB
InChI InChI=1S/C9H12N4OS2/c1-9(2,3)5-6(14)13-7(11-10-5)16-8(12-13)15-4/h1-4H3
InChIKey DTIOMVIQLDWCOB-UHFFFAOYSA-N
Mol Weight 256.34 g/mol
Molecular Formula C9H12N4OS2
Exact Mass 256.045253 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8lTBIC2OSlM
Name 3-tert-Butyl-7-(methylsulfanyl)-4H-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-4-one
Alternate Name(s) 3-tert-Butyl-7-(methylthio)-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-4-one 3-tert-Butyl-7-methylsulfanyl-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-4-one [1,3,4]Thiadiazolo[2,3-c][1,2,4]triazin-4-one, 3-tert-butyl-7-methylsulfanyl-
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Formula C9H12N4OS2
InChI InChI=1S/C9H12N4OS2/c1-9(2,3)5-6(14)13-7(11-10-5)16-8(12-13)15-4/h1-4H3
InChIKey DTIOMVIQLDWCOB-UHFFFAOYSA-N
Molecular Weight 256.342 g/mol
SMILES CSC1=NN2C(S1)=NN=C(C2=O)C(C)(C)C
SPLASH splash10-06rx-9430000000-c371119c2ce545c948a6
Wiley ID 1442002