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ethanone, 1-(4-methyl-5-oxido-1,2,5-oxadiazol-3-yl)-2-[(5-methyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)thio]-
SpectraBase Compound ID CadwWI4lcKZ
InChI InChI=1S/C15H12N6O3S/c1-8-12(19-24-21(8)23)11(22)7-25-15-16-14-13(17-18-15)9-5-3-4-6-10(9)20(14)2/h3-6H,7H2,1-2H3
InChIKey IEKASPVRPNXYQX-UHFFFAOYSA-N
Mol Weight 356.36 g/mol
Molecular Formula C15H12N6O3S
Exact Mass 356.069159 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2Peg7AfD5vy
Name 1-(4-Methyl-5-oxidanidyl-1,2,5-oxadiazol-5-ium-3-yl)-2-[(5-methyl-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]ethanone
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Formula C15H12N6O3S
InChI InChI=1S/C15H12N6O3S/c1-8-12(19-24-21(8)23)11(22)7-25-15-16-14-13(17-18-15)9-5-3-4-6-10(9)20(14)2/h3-6H,7H2,1-2H3
InChIKey IEKASPVRPNXYQX-UHFFFAOYSA-N
Molecular Weight 356.360 g/mol
SMILES c12c(c3ccccc3[n]2C)nnc(n1)SCC(c1c([n+]([O-])on1)C)=O
SPLASH splash10-0fbl-5961000000-05f59681c738e2513a0d
Synonyms 1-(4-Methyl-5-oxido-1,2,5-oxadiazol-5-ium-3-yl)-2-[(5-methyl-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]ethanone 1-(4-Methyl-5-oxido-1,2,5-oxadiazol-5-ium-3-yl)-2-[(5-methyl-[1,2,4]triazino[5,6-b]indol-3-yl)thio]ethanone 1-(4-Methyl-5-oxido-furazan-5-ium-3-yl)-2-[(5-methyl-[1,2,4]triazin[5,6-b]indol-3-yl)thio]ethanone
Wiley ID 1511252