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2-Methyl-1-[(4-methylphenyl)sulfonyl]-4-nitro-1Himidazole
SpectraBase Compound ID 85xO3L4JS6Q
InChI InChI=1S/C11H11N3O4S/c1-8-3-5-10(6-4-8)19(17,18)13-7-11(14(15)16)12-9(13)2/h3-7H,1-2H3
InChIKey NLXPVIKTNJNWOY-UHFFFAOYSA-N
Mol Weight 281.29 g/mol
Molecular Formula C11H11N3O4S
Exact Mass 281.047027 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CiVDdOWDEkG
Name 2-Methyl-1-[(4-methylphenyl)sulfonyl]-4-nitro-1Himidazole
Alternate Name(s) 2-Methyl-1-(4-methylphenyl)sulfonyl-4-nitro-imidazole 2-Methyl-1-(4-methylphenyl)sulfonyl-4-nitroimidazole 2-Methyl-4-nitro-1-(p-tolylsulfonyl)imidazole 2-Methyl-4-nitro-1-tosyl-imidazole
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Formula C11H11N3O4S
InChI InChI=1S/C11H11N3O4S/c1-8-3-5-10(6-4-8)19(17,18)13-7-11(14(15)16)12-9(13)2/h3-7H,1-2H3
InChIKey NLXPVIKTNJNWOY-UHFFFAOYSA-N
Molecular Weight 281.286 g/mol
SMILES c1(nc(c[n]1S(=O)(=O)c1ccc(cc1)C)N(=O)=O)C
SPLASH splash10-052f-9500000000-32303f32ee8fc0dfb098
Source of Spectrum F2-44-2982-11
Wiley ID 1716137