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6-Benzylsulfinyl-2-hexanone

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

6-Benzylsulfinyl-2-hexanone
SpectraBase Compound ID H7iK0bJynF2
InChI InChI=1S/C13H18O2S/c1-12(14)7-5-6-10-16(15)11-13-8-3-2-4-9-13/h2-4,8-9H,5-7,10-11H2,1H3
InChIKey SPGKNAZXVQLPKU-UHFFFAOYSA-N
Mol Weight 238.34 g/mol
Molecular Formula C13H18O2S
Exact Mass 238.102751 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7RyZH9RIyCm
Name 6-Benzylsulfinyl-2-hexanone
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H18O2S
InChI InChI=1S/C13H18O2S/c1-12(14)7-5-6-10-16(15)11-13-8-3-2-4-9-13/h2-4,8-9H,5-7,10-11H2,1H3
InChIKey SPGKNAZXVQLPKU-UHFFFAOYSA-N
Molecular Weight 238.345 g/mol
SMILES CC(CCCCS(=O)Cc1ccccc1)=O
SPLASH splash10-0006-9000000000-77c75183dae78f1d3c42
Source of Spectrum QC-8-695-18
Synonyms 6-(Phenylmethyl)sulfinyl-2-hexanone 6-(Phenylmethyl)sulfinylhexan-2-one
Wiley ID 869844