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4-iodo-1-(4-methylphenyl)sulfonyl-5-thiophen-2-yl-2,3-dihydropyrrole-2-carboxylic acid methyl ester
SpectraBase Compound ID 91Ta13QHTna
InChI InChI=1S/C17H16INO4S2/c1-11-5-7-12(8-6-11)25(21,22)19-14(17(20)23-2)10-13(18)16(19)15-4-3-9-24-15/h3-9,14H,10H2,1-2H3
InChIKey SSYJFLNDWVXUMN-UHFFFAOYSA-N
Mol Weight 489.34 g/mol
Molecular Formula C17H16INO4S2
Exact Mass 488.956545 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EoRlprkTuTh
Name 4-iodo-1-(4-methylphenyl)sulfonyl-5-thiophen-2-yl-2,3-dihydropyrrole-2-carboxylic acid methyl ester
Alternate Name(s) 4-iodo-5-(2-thienyl)-1-tosyl-2-pyrroline-2-carboxylic acid methyl ester Methyl 4-iodanyl-1-(4-methylphenyl)sulfonyl-5-thiophen-2-yl-2,3-dihydropyrrole-2-carboxylate Methyl 4-iodo-1-(4-methylphenyl)sulfonyl-5-thiophen-2-yl-2,3-dihydropyrrole-2-carboxylate Methyl 4-iodo-1-(p-tolylsulfonyl)-5-(2-thienyl)-2,3-dihydropyrrole-2-carboxylate
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Formula C17H16INO4S2
InChI InChI=1S/C17H16INO4S2/c1-11-5-7-12(8-6-11)25(21,22)19-14(17(20)23-2)10-13(18)16(19)15-4-3-9-24-15/h3-9,14H,10H2,1-2H3
InChIKey SSYJFLNDWVXUMN-UHFFFAOYSA-N
Molecular Weight 489.342 g/mol
SMILES c1(S(N2C(=C(I)CC2C(=O)OC)c2sccc2)(=O)=O)ccc(cc1)C
SPLASH splash10-00kf-9100000000-d06b37df84125ac2dd8d
Source of Spectrum K-2002-626-23
Wiley ID 1580903