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Ethanesulfonic acid, 2-[2-[2-(4-octylphenoxy)ethoxy]ethoxy]-, methyl ester
SpectraBase Compound ID AM7g3dNBkRa
InChI InChI=1S/C21H36O6S/c1-3-4-5-6-7-8-9-20-10-12-21(13-11-20)27-17-16-25-14-15-26-18-19-28(22,23)24-2/h10-13H,3-9,14-19H2,1-2H3
InChIKey ORSHQQALHRALQF-UHFFFAOYSA-N
Mol Weight 416.6 g/mol
Molecular Formula C21H36O6S
Exact Mass 416.22326 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4wHFtYmwPA
Name Ethanesulfonic acid, 2-[2-[2-(4-octylphenoxy)ethoxy]ethoxy]-, methyl ester
Alternate Name(s) Methyl 2-(2-(2-(4-octylphenoxy)ethoxy)ethoxy)ethanesulfonate Methyl 2-{2-[2-(4-octylphenoxy)ethoxy]ethoxy}ethanesulfonate Methyl 2-[2-[2-(4-octylphenoxy)ethoxy]ethoxy]ethanesulfonate
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Formula C21H36O6S
InChI InChI=1S/C21H36O6S/c1-3-4-5-6-7-8-9-20-10-12-21(13-11-20)27-17-16-25-14-15-26-18-19-28(22,23)24-2/h10-13H,3-9,14-19H2,1-2H3
InChIKey ORSHQQALHRALQF-UHFFFAOYSA-N
Molecular Weight 416.573 g/mol
SMILES CCCCCCCCc1ccc(OCCOCCOCCS(=O)(=O)OC)cc1
SPLASH splash10-059b-9813000000-0c9fd6f56e0ae0134fb1
Source of Spectrum JX-2015-4-226
Wiley ID 1725675