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1-(2-esylethyl)-5-iodo-2-methyl-4-nitro-imidazole
SpectraBase Compound ID L6xwnkNV1pd
InChI InChI=1S/C8H12IN3O4S/c1-3-17(15,16)5-4-11-6(2)10-8(7(11)9)12(13)14/h3-5H2,1-2H3
InChIKey DAQQNSOGJTTXBA-UHFFFAOYSA-N
Mol Weight 373.17 g/mol
Molecular Formula C8H12IN3O4S
Exact Mass 372.959322 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FyLUL8irl92
Name 1-(2-esylethyl)-5-iodo-2-methyl-4-nitro-imidazole
Alternate Name(s) 1-(2-Ethylsulfonylethyl)-5-iodanyl-2-methyl-4-nitro-imidazole 1-(2-Ethylsulfonylethyl)-5-iodo-2-methyl-4-nitro-imidazole 1-[2-(ethylsulfonyl)ethyl]-5-iodo-2-methyl-4-nitro-1H-imidazole
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Formula C8H12IN3O4S
InChI InChI=1S/C8H12IN3O4S/c1-3-17(15,16)5-4-11-6(2)10-8(7(11)9)12(13)14/h3-5H2,1-2H3
InChIKey DAQQNSOGJTTXBA-UHFFFAOYSA-N
Molecular Weight 373.165 g/mol
SMILES c1(nc(C)[n](c1I)CCS(=O)(=O)CC)N(=O)=O
SPLASH splash10-0002-0090000000-14a8bfec60f934f89849
Source of Spectrum SK-24-360-2
Wiley ID 866048