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Phenacyl 4-(4-chlorophenylsulfonyl)benzoate

View entire compound with spectra: 1 NMR, 1 FTIR, and 2 MS (GC)

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 Crtgx6okHau
Name PHENACYL 4-(4-CHLOROPHENYLSULFONYL)BENZOATE
Copyright Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved.
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 414.0325
SMILES c1(S(c2ccc(Cl)cc2)(=O)=O)ccc(C(OCC(c2ccccc2)=O)=O)cc1
SPLASH splash10-0a4i-8900000000-dbf4fc1b9fb68952e57e
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany