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2-(benzenesulfonyl)-3-(4-chlorophenyl)propanoic acid ethyl ester
SpectraBase Compound ID IUAOZiImrih
InChI InChI=1S/C17H17ClO4S/c1-2-22-17(19)16(12-13-8-10-14(18)11-9-13)23(20,21)15-6-4-3-5-7-15/h3-11,16H,2,12H2,1H3
InChIKey HBWVVZDJMUWQHA-UHFFFAOYSA-N
Mol Weight 352.83 g/mol
Molecular Formula C17H17ClO4S
Exact Mass 352.053608 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EpqNFIQ5Y3Q
Name 2-(benzenesulfonyl)-3-(4-chlorophenyl)propanoic acid ethyl ester
Comments Less than 3 mono-isotopic peaks
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Formula C17H17ClO4S
InChI InChI=1S/C17H17ClO4S/c1-2-22-17(19)16(12-13-8-10-14(18)11-9-13)23(20,21)15-6-4-3-5-7-15/h3-11,16H,2,12H2,1H3
InChIKey HBWVVZDJMUWQHA-UHFFFAOYSA-N
Molecular Weight 352.832 g/mol
SMILES C(S(=O)(=O)c1ccccc1)(C(=O)OCC)Cc1ccc(cc1)Cl
SPLASH splash10-0a4i-0009000000-3471faa8c4813f7bfed8
Source of Spectrum SK-22-2289-2
Synonyms 2-besyl-3-(4-chlorophenyl)propionic acid ethyl ester ethyl 2-(benzenesulfonyl)-3-(4-chlorophenyl)propanoate ethyl 3-(4-chlorophenyl)-2-(phenylsulfonyl)propanoate
Wiley ID 852160