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2-(benzenesulfinyl)-2-methyl-1-cyclohexadecanone
SpectraBase Compound ID KETzSWJHruA
InChI InChI=1S/C23H36O2S/c1-23(26(25)21-17-13-12-14-18-21)20-16-11-9-7-5-3-2-4-6-8-10-15-19-22(23)24/h12-14,17-18H,2-11,15-16,19-20H2,1H3
InChIKey OMSQZBPALZRYTL-UHFFFAOYSA-N
Mol Weight 376.6 g/mol
Molecular Formula C23H36O2S
Exact Mass 376.243602 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3NRjKilqB4h
Name 2-(benzenesulfinyl)-2-methyl-1-cyclohexadecanone
Alternate Name(s) 2-(benzenesulfinyl)-2-methyl-cyclohexadecanone 2-(benzenesulfinyl)-2-methylcyclohexadecan-1-one 2-Methyl-2-(phenylsulfinyl)cyclohexadecan-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H36O2S
InChI InChI=1S/C23H36O2S/c1-23(26(25)21-17-13-12-14-18-21)20-16-11-9-7-5-3-2-4-6-8-10-15-19-22(23)24/h12-14,17-18H,2-11,15-16,19-20H2,1H3
InChIKey OMSQZBPALZRYTL-UHFFFAOYSA-N
Molecular Weight 376.599 g/mol
SMILES C1(S(=O)c2ccccc2)(C(=O)CCCCCCCCCCCCCC1)C
SPLASH splash10-0fb9-0971000000-46db1f3d7fa2edae3036
Source of Spectrum F-51-9337-32
Wiley ID 793267