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2-(Phenylsulfonyl)ethyl 3-Phenylpropanoate
SpectraBase Compound ID 4cvtB7ruUB7
InChI InChI=1S/C17H18O4S/c18-17(12-11-15-7-3-1-4-8-15)21-13-14-22(19,20)16-9-5-2-6-10-16/h1-10H,11-14H2
InChIKey LBZBVVNQYMGZDW-UHFFFAOYSA-N
Mol Weight 318.39 g/mol
Molecular Formula C17H18O4S
Exact Mass 318.09258 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4C7JH5xcS8
Name 2-(Phenylsulfonyl)ethyl 3-Phenylpropanoate
Alternate Name(s) 2-(benzenesulfonyl)ethyl 3-phenylpropanoate 3-Phenylpropanoic acid 2-(benzenesulfonyl)ethyl ester 3-Phenylpropionic acid 2-besylethyl ester
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Formula C17H18O4S
InChI InChI=1S/C17H18O4S/c18-17(12-11-15-7-3-1-4-8-15)21-13-14-22(19,20)16-9-5-2-6-10-16/h1-10H,11-14H2
InChIKey LBZBVVNQYMGZDW-UHFFFAOYSA-N
Molecular Weight 318.387 g/mol
SMILES C(CCc1ccccc1)(=O)OCCS(=O)(=O)c1ccccc1
SPLASH splash10-015i-0910000000-706faaf3352b79565022
Source of Spectrum CV-2003-284-4
Wiley ID 1610777