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2-[2-(Phenylsulfinyl)-2-propenyl]cyclohexanone
SpectraBase Compound ID L0r6ACjt7XI
InChI InChI=1S/C15H18O2S/c1-12(11-13-7-5-6-10-15(13)16)18(17)14-8-3-2-4-9-14/h2-4,8-9,13H,1,5-7,10-11H2
InChIKey DZDFOLFVRWFLTM-UHFFFAOYSA-N
Mol Weight 262.37 g/mol
Molecular Formula C15H18O2S
Exact Mass 262.102751 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DdhwC7kJuKx
Name 2-[2-(Phenylsulfinyl)-2-propenyl]cyclohexanone
CAS Registry Number 90838-48-5
Comments Less than 3 mono-isotopic peaks
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Formula C15H18O2S
InChI InChI=1S/C15H18O2S/c1-12(11-13-7-5-6-10-15(13)16)18(17)14-8-3-2-4-9-14/h2-4,8-9,13H,1,5-7,10-11H2
InChIKey DZDFOLFVRWFLTM-UHFFFAOYSA-N
Molecular Weight 262.367 g/mol
SMILES C(S(=O)c1ccccc1)(CC1C(=O)CCCC1)=C
SPLASH splash10-03di-0090000000-a2d07ec899b4bb2feca2
Source of Spectrum J-49-3137-0
Synonyms 2-[2-(benzenesulfinyl)prop-2-enyl]-1-cyclohexanone 2-[2-(benzenesulfinyl)prop-2-enyl]cyclohexan-1-one 2-[2-(phenylsulfinyl)prop-2-enyl]cyclohexan-1-one
Wiley ID 104008