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Methyl (2RS,4RS,5SR)-4-iodo-1-(4-tolylsulfonyl)-5-(2-furyl)pyrrolidine-2-carboxylate
SpectraBase Compound ID 956bQ3iuC0K
InChI InChI=1S/C17H18INO5S/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/h3-9,13-14,16H,10H2,1-2H3/t13-,14-,16-/m0/s1
InChIKey PCHMNMMOHSMNGY-DZKIICNBSA-N
Mol Weight 475.3 g/mol
Molecular Formula C17H18INO5S
Exact Mass 474.995039 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3gueKlSTzs
Name Methyl (2RS,4RS,5SR)-4-iodo-1-(4-tolylsulfonyl)-5-(2-furyl)pyrrolidine-2-carboxylate
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Formula C17H18INO5S
InChI InChI=1S/C17H18INO5S/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/h3-9,13-14,16H,10H2,1-2H3/t13-,14-,16-/m0/s1
InChIKey PCHMNMMOHSMNGY-DZKIICNBSA-N
Molecular Weight 475.297 g/mol
SMILES c1(S(N2[C@@](C[C@@]([C@]2(c2occc2)[H])(I)[H])(C(=O)OC)[H])(=O)=O)ccc(cc1)C
SPLASH splash10-0536-4912100000-047511d41feba6ad66e9
Source of Spectrum K-2001-2880-12
Wiley ID 1580005