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Diethyl 2-oxo-5-tridecyl-3-[(phenylsulfonyl)methyl]-tetrahydrofuran-3,4-dicarboxylate
SpectraBase Compound ID I5w3cRlDNgE
InChI InChI=1S/C30H46O8S/c1-4-7-8-9-10-11-12-13-14-15-19-22-25-26(27(31)36-5-2)30(29(33)38-25,28(32)37-6-3)23-39(34,35)24-20-17-16-18-21-24/h16-18,20-21,25-26H,4-15,19,22-23H2,1-3H3
InChIKey VTKWESXMLLMSSO-UHFFFAOYSA-N
Mol Weight 566.8 g/mol
Molecular Formula C30H46O8S
Exact Mass 566.29134 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B89zYVGxAN5
Name Diethyl 2-oxo-5-tridecyl-3-[(phenylsulfonyl)methyl]-tetrahydrofuran-3,4-dicarboxylate
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Formula C30H46O8S
InChI InChI=1S/C30H46O8S/c1-4-7-8-9-10-11-12-13-14-15-19-22-25-26(27(31)36-5-2)30(29(33)38-25,28(32)37-6-3)23-39(34,35)24-20-17-16-18-21-24/h16-18,20-21,25-26H,4-15,19,22-23H2,1-3H3
InChIKey VTKWESXMLLMSSO-UHFFFAOYSA-N
Molecular Weight 566.750 g/mol
SMILES C1(C(OC(C1C(=O)OCC)CCCCCCCCCCCCC)=O)(CS(=O)(=O)c1ccccc1)C(=O)OCC
SPLASH splash10-00mo-9643300000-7be36e6012fa2f300ce7
Source of Spectrum H-85-3809-18
Synonyms Diethyl 3-[(phenylsulfonyl)methyl]-2-oxo-tetrahydro-5-tridecylfuran-3,4-dicarboxylate Diethyl 2-oxo-3-[(phenylsulfonyl)methyl]-5-tridecyltetrahydro-3,4-furandicarboxylate
Wiley ID 1524913