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2-Methyl-3-phenyl-2-(phenylthio)propanoic acid ethyl ester
SpectraBase Compound ID 8ISHgbY2QPI
InChI InChI=1S/C18H20O2S/c1-3-20-17(19)18(2,14-15-10-6-4-7-11-15)21-16-12-8-5-9-13-16/h4-13H,3,14H2,1-2H3
InChIKey VOIQOBZOIVAFQH-UHFFFAOYSA-N
Mol Weight 300.42 g/mol
Molecular Formula C18H20O2S
Exact Mass 300.118401 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4QlpTSuidWs
Name 2-Methyl-3-phenyl-2-(phenylthio)propanoic acid ethyl ester
Alternate Name(s) 2-Methyl-3-phenyl-2-(phenylthio)propionic acid ethyl ester Ethyl 2-methyl-3-phenyl-2-phenylsulfanylpropanoate
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Formula C18H20O2S
InChI InChI=1S/C18H20O2S/c1-3-20-17(19)18(2,14-15-10-6-4-7-11-15)21-16-12-8-5-9-13-16/h4-13H,3,14H2,1-2H3
InChIKey VOIQOBZOIVAFQH-UHFFFAOYSA-N
Molecular Weight 300.416 g/mol
SMILES C(C(=O)OCC)(Sc1ccccc1)(Cc1ccccc1)C
SPLASH splash10-0a4i-4894000000-fc56268645098404779e
Source of Spectrum F-54-2806-17
Wiley ID 806376