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4-(4-Chlorophenyl)-4-phenylsulfanyl-butan-2-one

View entire compound with spectra: 1 MS (GC)

4-(4-Chlorophenyl)-4-phenylsulfanyl-butan-2-one
SpectraBase Compound ID K0QBs9QcRoa
InChI InChI=1S/C16H15ClOS/c1-12(18)11-16(13-7-9-14(17)10-8-13)19-15-5-3-2-4-6-15/h2-10,16H,11H2,1H3
InChIKey RQLYJAAETOPOLY-UHFFFAOYSA-N
Mol Weight 290.81 g/mol
Molecular Formula C16H15ClOS
Exact Mass 290.053214 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I1rdJqz8KID
Name 4-(4-Chlorophenyl)-4-phenylsulfanyl-butan-2-one
Alternate Name(s) 4-(4-Chlorophenyl)-4-(phenylthio)butan-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H15ClOS
InChI InChI=1S/C16H15ClOS/c1-12(18)11-16(13-7-9-14(17)10-8-13)19-15-5-3-2-4-6-15/h2-10,16H,11H2,1H3
InChIKey RQLYJAAETOPOLY-UHFFFAOYSA-N
Literature Reference DOI 10.1039/c1gc15790f
Molecular Weight 290.808 g/mol
SMILES c1cc(ccc1Cl)C(Sc1ccccc1)CC(C)=O
SPLASH splash10-000x-9750000000-589b6e2f1a2740b75dc8
Source of Spectrum GCH-13-3181/SMS8-11
Wiley ID 1760688