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Benzoic acid, 4,4'-[methylenebis(sulfonyloxy)]bis-, dimethyl ester
SpectraBase Compound ID 1g8keqV0xMk
InChI InChI=1S/C17H16O10S2/c1-24-16(18)12-3-7-14(8-4-12)26-28(20,21)11-29(22,23)27-15-9-5-13(6-10-15)17(19)25-2/h3-10H,11H2,1-2H3
InChIKey MYOKSMGOMKYZII-UHFFFAOYSA-N
Mol Weight 444.43 g/mol
Molecular Formula C17H16O10S2
Exact Mass 444.018489 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FVeDoVFTvBb
Name Benzoic acid, 4,4'-[methylenebis(sulfonyloxy)]bis-, dimethyl ester
Alternate Name(s) Dimethyl 4,4'-(methylenedisulfonylbis(oxy))dibenzoate Dimethyl 4,4'-[methanediylbis(sulfonyloxy)]dibenzoate 4-[(4-methoxycarbonylphenoxy)sulfonylmethylsulfonyloxy]benzoic acid methyl ester Methyl 4-[(4-methoxycarbonylphenoxy)sulfonylmethylsulfonyloxy]benzoate
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Formula C17H16O10S2
InChI InChI=1S/C17H16O10S2/c1-24-16(18)12-3-7-14(8-4-12)26-28(20,21)11-29(22,23)27-15-9-5-13(6-10-15)17(19)25-2/h3-10H,11H2,1-2H3
InChIKey MYOKSMGOMKYZII-UHFFFAOYSA-N
Molecular Weight 444.425 g/mol
SMILES COC(=O)c1ccc(OS(=O)(=O)CS(=O)(=O)Oc2ccc(cc2)C(=O)OC)cc1
SPLASH splash10-0fk9-4900000000-43019677eaa11374a198
Source of Spectrum JX-2015-4-529
Wiley ID 1725961