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1-[(Phenylthio)carbonyl]ethyl benzoate
SpectraBase Compound ID 3qLGgxk61CF
InChI InChI=1S/C16H14O3S/c1-12(16(18)20-14-10-6-3-7-11-14)19-15(17)13-8-4-2-5-9-13/h2-12H,1H3
InChIKey YKXVCNQSNNYEBZ-UHFFFAOYSA-N
Mol Weight 286.35 g/mol
Molecular Formula C16H14O3S
Exact Mass 286.066365 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5yTtrPgTZq5
Name 1-[(Phenylthio)carbonyl]ethyl benzoate
Alternate Name(s) 1-Oxo-1-(phenylthio)propan-2-yl benzoate
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Formula C16H14O3S
InChI InChI=1S/C16H14O3S/c1-12(16(18)20-14-10-6-3-7-11-14)19-15(17)13-8-4-2-5-9-13/h2-12H,1H3
InChIKey YKXVCNQSNNYEBZ-UHFFFAOYSA-N
Literature Reference DOI 10.1002/adsc.201000376
Molecular Weight 286.345 g/mol
SMILES C(c1ccccc1)(=O)OC(C)C(=O)Sc1ccccc1
SPLASH splash10-0a6r-2900000000-e454b2d33650efae4813
Source of Spectrum ASC-352-2958-2b
Wiley ID 1764059