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N-(2,6-dimethylphenyl)-2-[1-(4-iodophenyl)tetrazol-5-yl]sulfanyl-acetamide
SpectraBase Compound ID HqGXcD8EkZ2
InChI InChI=1S/C17H16IN5OS/c1-11-4-3-5-12(2)16(11)19-15(24)10-25-17-20-21-22-23(17)14-8-6-13(18)7-9-14/h3-9H,10H2,1-2H3,(H,19,24)
InChIKey MYBKTDPEFRENKO-UHFFFAOYSA-N
Mol Weight 465.31 g/mol
Molecular Formula C17H16IN5OS
Exact Mass 465.012026 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1iJTANviZwo
Name N-(2,6-dimethylphenyl)-2-[1-(4-iodophenyl)tetrazol-5-yl]sulfanyl-acetamide
Alternate Name(s) N-(2,6-dimethylphenyl)-2-[[1-(4-iodophenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]ethanamide N-(2,6-dimethylphenyl)-2-[[1-(4-iodophenyl)-5-tetrazolyl]thio]acetamide N-(2,6-dimethylphenyl)-2-[[1-(4-iodophenyl)tetrazol-5-yl]thio]acetamide
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Formula C17H16IN5OS
InChI InChI=1S/C17H16IN5OS/c1-11-4-3-5-12(2)16(11)19-15(24)10-25-17-20-21-22-23(17)14-8-6-13(18)7-9-14/h3-9H,10H2,1-2H3,(H,19,24)
InChIKey MYBKTDPEFRENKO-UHFFFAOYSA-N
Molecular Weight 465.313 g/mol
SMILES N(C(CSc1nnn[n]1-c1ccc(I)cc1)=O)c1c(cccc1C)C
SPLASH splash10-0fml-7900000000-c127f7b01ab97797908b
Wiley ID 1445735