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Dimethyl 3-[(benzenesulfonyl)methyl]-4-[(phenylthio)methyl]cyclopentane-1,1-dicarboxylate
SpectraBase Compound ID EcwNn2S9kud
InChI InChI=1S/C23H26O6S2/c1-28-21(24)23(22(25)29-2)13-17(15-30-19-9-5-3-6-10-19)18(14-23)16-31(26,27)20-11-7-4-8-12-20/h3-12,17-18H,13-16H2,1-2H3
InChIKey CNRXOXSCPKZAFP-UHFFFAOYSA-N
Mol Weight 462.58 g/mol
Molecular Formula C23H26O6S2
Exact Mass 462.117081 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GGJBMLi6AcM
Name Dimethyl 3-[(benzenesulfonyl)methyl]-4-[(phenylthio)methyl]cyclopentane-1,1-dicarboxylate
Alternate Name(s) Dimethyl 3-[(phenylsulfanyl)methyl]-4-[(phenylsulfonyl)methyl]-1,1-cyclopentanedicarboxylate
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Formula C23H26O6S2
InChI InChI=1S/C23H26O6S2/c1-28-21(24)23(22(25)29-2)13-17(15-30-19-9-5-3-6-10-19)18(14-23)16-31(26,27)20-11-7-4-8-12-20/h3-12,17-18H,13-16H2,1-2H3
InChIKey CNRXOXSCPKZAFP-UHFFFAOYSA-N
Molecular Weight 462.575 g/mol
SMILES C1(CC(CS(=O)(=O)c2ccccc2)C(C1)CSc1ccccc1)(C(=O)OC)C(=O)OC
SPLASH splash10-0ikc-9764400000-d20c70dde7f1fb91bd45
Source of Spectrum SK-23-3560-11
Wiley ID 865793