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6,6-Dimethyl-4-(2-(phenylsulfonyl)ethyl)tetrahydro-2H-pyran-2-one
SpectraBase Compound ID DACzLZImmIJ
InChI InChI=1S/C15H20O4S/c1-15(2)11-12(10-14(16)19-15)8-9-20(17,18)13-6-4-3-5-7-13/h3-7,12H,8-11H2,1-2H3
InChIKey CCCITPXNTVTRCS-UHFFFAOYSA-N
Mol Weight 296.38 g/mol
Molecular Formula C15H20O4S
Exact Mass 296.10823 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GmJyzp6DmUg
Name 6,6-Dimethyl-4-(2-(phenylsulfonyl)ethyl)tetrahydro-2H-pyran-2-one
Appearance Colorless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H20O4S
InChI InChI=1S/C15H20O4S/c1-15(2)11-12(10-14(16)19-15)8-9-20(17,18)13-6-4-3-5-7-13/h3-7,12H,8-11H2,1-2H3
InChIKey CCCITPXNTVTRCS-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1002/chem.201701865
Molecular Weight 296.381 g/mol
Quality 236
Reported Formula C15H20O4S
SMILES CC1(CC(CC(O1)=O)CCS(C1=CC=CC=C1)(=O)=O)C
SPLASH splash10-0a4m-9510000000-358989493ff5823b9f3a
Source of Spectrum QE-23-SM14-3g (DOI: 10.1002/chem.201701865)
Wiley ID 1905569