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4-Chloro-5-methyl-1-phenyl-4-(p-tolylsulfonyl)-3-hexanone
SpectraBase Compound ID DtOfuxS7iE5
InChI InChI=1S/C20H23ClO3S/c1-15(2)20(21,19(22)14-11-17-7-5-4-6-8-17)25(23,24)18-12-9-16(3)10-13-18/h4-10,12-13,15H,11,14H2,1-3H3
InChIKey UKVFMRVIKQDUIV-UHFFFAOYSA-N
Mol Weight 378.91 g/mol
Molecular Formula C20H23ClO3S
Exact Mass 378.105643 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5BUcoVWIMz1
Name 4-Chloro-5-methyl-1-phenyl-4-(p-tolylsulfonyl)-3-hexanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H23ClO3S
InChI InChI=1S/C20H23ClO3S/c1-15(2)20(21,19(22)14-11-17-7-5-4-6-8-17)25(23,24)18-12-9-16(3)10-13-18/h4-10,12-13,15H,11,14H2,1-3H3
InChIKey UKVFMRVIKQDUIV-UHFFFAOYSA-N
Molecular Weight 378.914 g/mol
SMILES C(CC(C(C(C)C)(S(=O)(=O)c1ccc(cc1)C)Cl)=O)c1ccccc1
SPLASH splash10-001i-0910000000-baa4de8eaba08f98d3bb
Source of Spectrum AJ-66-2343-2
Synonyms 4-Chloro-5-methyl-4-[(4-methylphenyl)sulfonyl]-1-phenyl-3-hexanone
Wiley ID 772191