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6-methyl-1-(2-methylphenyl)-[1,2,4]triazolo[3,4-b][1,3]benzothiazole
SpectraBase Compound ID KVedDhCAyoH
InChI InChI=1S/C16H13N3S/c1-10-7-8-13-14(9-10)20-16-18-17-15(19(13)16)12-6-4-3-5-11(12)2/h3-9H,1-2H3
InChIKey IMUFQJYZJWXEJL-UHFFFAOYSA-N
Mol Weight 279.36 g/mol
Molecular Formula C16H13N3S
Exact Mass 279.083019 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HCVZTYld7YK
Name 6-methyl-1-(2-methylphenyl)-[1,2,4]triazolo[3,4-b][1,3]benzothiazole
Comments Less than 3 mono-isotopic peaks
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Formula C16H13N3S
InChI InChI=1S/C16H13N3S/c1-10-7-8-13-14(9-10)20-16-18-17-15(19(13)16)12-6-4-3-5-11(12)2/h3-9H,1-2H3
InChIKey IMUFQJYZJWXEJL-UHFFFAOYSA-N
Molecular Weight 279.361 g/mol
SMILES c12[n](c(nn2)-c2c(C)cccc2)-c2c(S1)cc(cc2)C
SPLASH splash10-01t9-0490000000-6dc034c4582a91aec6b3
Source of Spectrum J-62-5770-4
Synonyms 6-methyl-1-(o-tolyl)-[1,2,4]triazolo[3,4-b][1,3]benzothiazole
Wiley ID 1283021