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3-Phenyl-5-(1-phenylethylthio)benzene-1,2-dicarboxylic acid dimethyl ester
SpectraBase Compound ID 8csHwr7lUM4
InChI InChI=1S/C24H22O4S/c1-16(17-10-6-4-7-11-17)29-19-14-20(18-12-8-5-9-13-18)22(24(26)28-3)21(15-19)23(25)27-2/h4-16H,1-3H3
InChIKey BWGIPTZKOYSEJO-UHFFFAOYSA-N
Mol Weight 406.5 g/mol
Molecular Formula C24H22O4S
Exact Mass 406.12388 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1fnYHeUiJQK
Name 3-Phenyl-5-(1-phenylethylthio)benzene-1,2-dicarboxylic acid dimethyl ester
Alternate Name(s) Dimethyl 3-phenyl-5-(1-phenylethylsulfanyl)benzene-1,2-dicarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H22O4S
InChI InChI=1S/C24H22O4S/c1-16(17-10-6-4-7-11-17)29-19-14-20(18-12-8-5-9-13-18)22(24(26)28-3)21(15-19)23(25)27-2/h4-16H,1-3H3
InChIKey BWGIPTZKOYSEJO-UHFFFAOYSA-N
Molecular Weight 406.496 g/mol
SMILES c1(c(c(cc(c1)SC(C)c1ccccc1)C(=O)OC)C(=O)OC)-c1ccccc1
SPLASH splash10-0a4i-0943100000-492468a11cc0c1634d22
Source of Spectrum J-64-6187-16
Wiley ID 1530780