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6-(4-iodophenyl)-3-(5-methyl-1-(p-tolyl)-1H-1,2,3-triazol-4-yl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
SpectraBase Compound ID LIdm96iKLHC
InChI InChI=1S/C19H14IN7S/c1-11-3-9-15(10-4-11)26-12(2)16(21-25-26)17-22-23-19-27(17)24-18(28-19)13-5-7-14(20)8-6-13/h3-10H,1-2H3
InChIKey OIKMOROUDOXULV-UHFFFAOYSA-N
Mol Weight 499.33 g/mol
Molecular Formula C19H14IN7S
Exact Mass 499.00761 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1UrByHHFQ6Q
Name 6-(4-iodophenyl)-3-(5-methyl-1-(p-tolyl)-1H-1,2,3-triazol-4-yl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
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Formula C19H14IN7S
InChI InChI=1S/C19H14IN7S/c1-11-3-9-15(10-4-11)26-12(2)16(21-25-26)17-22-23-19-27(17)24-18(28-19)13-5-7-14(20)8-6-13/h3-10H,1-2H3
InChIKey OIKMOROUDOXULV-UHFFFAOYSA-N
Molecular Weight 499.334 g/mol
SMILES c1([n]2N=C(Sc2nn1)c1ccc(cc1)I)-c1nn[n](-c2ccc(cc2)C)c1C
SPLASH splash10-02ml-4940100000-836eb7690bff8ad680a5
Source of Spectrum Y1-41B-1954-6e
Wiley ID 1744174