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Phenacyl 4-(4-chlorophenylsulfonyl)benzoate
SpectraBase Compound ID KgnAdg9OzLF
InChI InChI=1S/C21H15ClO5S/c22-17-8-12-19(13-9-17)28(25,26)18-10-6-16(7-11-18)21(24)27-14-20(23)15-4-2-1-3-5-15/h1-13H,14H2
InChIKey AIARGGKVMPNDEJ-UHFFFAOYSA-N
Mol Weight 414.86 g/mol
Molecular Formula C21H15ClO5S
Exact Mass 414.032872 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F76ZqUg394J
Name Phenacyl 4-(4-chlorophenylsulfonyl)benzoate
Alternate Name(s) 2-Oxo-2-phenylethyl 4-[(4-chlorophenyl)sulfonyl]benzoate 4-(4-Chlorophenyl)sulfonylbenzoic acid phenacyl ester
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Formula C21H15ClO5S
InChI InChI=1S/C21H15ClO5S/c22-17-8-12-19(13-9-17)28(25,26)18-10-6-16(7-11-18)21(24)27-14-20(23)15-4-2-1-3-5-15/h1-13H,14H2
InChIKey AIARGGKVMPNDEJ-UHFFFAOYSA-N
Molecular Weight 414.859 g/mol
SMILES c1(ccc(cc1)C(=O)OCC(=O)c1ccccc1)S(=O)(=O)c1ccc(cc1)Cl
SPLASH splash10-0a4i-8900000000-6b7313b50fedf862b0da
Wiley ID 1468350