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Methyl 4,4"-Bis(mercaptomethyl)-1,1':3',1"-terphenyl-2'-carboxylate
SpectraBase Compound ID QEfbiYxzSH
InChI InChI=1S/C22H20O2S2/c1-24-22(23)21-19(17-9-5-15(13-25)6-10-17)3-2-4-20(21)18-11-7-16(14-26)8-12-18/h2-12,25-26H,13-14H2,1H3
InChIKey OQKRFAGISHLZCG-UHFFFAOYSA-N
Mol Weight 380.52 g/mol
Molecular Formula C22H20O2S2
Exact Mass 380.090472 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BXSQeYWh3yS
Name Methyl 4,4"-Bis(mercaptomethyl)-1,1':3',1"-terphenyl-2'-carboxylate
Alternate Name(s) Methyl 2,6-bis[4-(sulfanylmethyl)phenyl]benzoate
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Formula C22H20O2S2
InChI InChI=1S/C22H20O2S2/c1-24-22(23)21-19(17-9-5-15(13-25)6-10-17)3-2-4-20(21)18-11-7-16(14-26)8-12-18/h2-12,25-26H,13-14H2,1H3
InChIKey OQKRFAGISHLZCG-UHFFFAOYSA-N
Molecular Weight 380.520 g/mol
SMILES SCc1ccc(-c2c(c(-c3ccc(CS)cc3)ccc2)C(=O)OC)cc1
SPLASH splash10-0a4i-0944000000-392f4f42853cd9879136
Source of Spectrum F-51-1329-6
Wiley ID 790706