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2-(p-Methoxyphenylthio)cyclohexanone
SpectraBase Compound ID 2yNEo0CLaGm
InChI InChI=1S/C13H16O2S/c1-15-10-6-8-11(9-7-10)16-13-5-3-2-4-12(13)14/h6-9,13H,2-5H2,1H3
InChIKey NESNJGILYGANHV-UHFFFAOYSA-N
Mol Weight 236.33 g/mol
Molecular Formula C13H16O2S
Exact Mass 236.087101 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FV3FYQlrHqH
Name 2-(p-Methoxyphenylthio)cyclohexanone
Alternate Name(s) 2-[(4-methoxyphenyl)thio]-1-cyclohexanone 2-(4-Methoxyphenyl)sulfanylcyclohexanone 2-(4-methoxyphenyl)sulfanylcyclohexan-1-one
Comments Less than 3 mono-isotopic peaks
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Formula C13H16O2S
InChI InChI=1S/C13H16O2S/c1-15-10-6-8-11(9-7-10)16-13-5-3-2-4-12(13)14/h6-9,13H,2-5H2,1H3
InChIKey NESNJGILYGANHV-UHFFFAOYSA-N
Molecular Weight 236.329 g/mol
SMILES C1(Sc2ccc(cc2)OC)C(=O)CCCC1
SPLASH splash10-000l-0690000000-a7bbbd1240845cd21d77
Source of Spectrum E1-58-1351-0
Wiley ID 1661945