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1-Tosyl-2-hexanone

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

1-Tosyl-2-hexanone
SpectraBase Compound ID Kw4WI0D959
InChI InChI=1S/C13H18O3S/c1-3-4-5-12(14)10-17(15,16)13-8-6-11(2)7-9-13/h6-9H,3-5,10H2,1-2H3
InChIKey STFFBROVGBZABT-UHFFFAOYSA-N
Mol Weight 254.34 g/mol
Molecular Formula C13H18O3S
Exact Mass 254.097666 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8SMPWQgi8wE
Name 1-Tosyl-2-hexanone
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H18O3S
InChI InChI=1S/C13H18O3S/c1-3-4-5-12(14)10-17(15,16)13-8-6-11(2)7-9-13/h6-9H,3-5,10H2,1-2H3
InChIKey STFFBROVGBZABT-UHFFFAOYSA-N
Molecular Weight 254.344 g/mol
SMILES C(C(CCCC)=O)S(=O)(=O)c1ccc(C)cc1
SPLASH splash10-052r-9600000000-c5167985549839f1b96f
Source of Spectrum AJ-65-1387-9
Synonyms 1-[(4-methylphenyl)sulfonyl]-2-hexanone
Wiley ID 771322