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3,3-Di(4-chlorophenylthio)-3-phenylpropanic acid ethyl ester
SpectraBase Compound ID BBhnFlsZS5x
InChI InChI=1S/C23H20Cl2O2S2/c1-2-27-22(26)16-23(17-6-4-3-5-7-17,28-20-12-8-18(24)9-13-20)29-21-14-10-19(25)11-15-21/h3-15H,2,16H2,1H3
InChIKey JWNUHFFVKRTDLV-UHFFFAOYSA-N
Mol Weight 463.44 g/mol
Molecular Formula C23H20Cl2O2S2
Exact Mass 462.028178 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6xTz9izojZV
Name 3,3-Di(4-chlorophenylthio)-3-phenylpropanic acid ethyl ester
Alternate Name(s) Ethyl 3,3-bis[(4-chlorophenyl)sulfanyl]-3-phenylpropanoate
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Formula C23H20Cl2O2S2
InChI InChI=1S/C23H20Cl2O2S2/c1-2-27-22(26)16-23(17-6-4-3-5-7-17,28-20-12-8-18(24)9-13-20)29-21-14-10-19(25)11-15-21/h3-15H,2,16H2,1H3
InChIKey JWNUHFFVKRTDLV-UHFFFAOYSA-N
Molecular Weight 463.437 g/mol
SMILES C(CC(=O)OCC)(Sc1ccc(cc1)Cl)(Sc1ccc(cc1)Cl)c1ccccc1
SPLASH splash10-052f-0902000000-3c90ce7bbc65435f4f5e
Source of Spectrum AJ-63-848-8
Wiley ID 1390964