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4-methyl-1-(4-methylphenyl)sulfonyl-piperidin-2-one
SpectraBase Compound ID 8RUXy7MQTPY
InChI InChI=1S/C13H17NO3S/c1-10-3-5-12(6-4-10)18(16,17)14-8-7-11(2)9-13(14)15/h3-6,11H,7-9H2,1-2H3
InChIKey SQNQIHWBJPWTEB-UHFFFAOYSA-N
Mol Weight 267.34 g/mol
Molecular Formula C13H17NO3S
Exact Mass 267.092915 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5TRIC4aMX9v
Name 4-methyl-1-(4-methylphenyl)sulfonyl-piperidin-2-one
Comments Less than 3 mono-isotopic peaks
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Formula C13H17NO3S
InChI InChI=1S/C13H17NO3S/c1-10-3-5-12(6-4-10)18(16,17)14-8-7-11(2)9-13(14)15/h3-6,11H,7-9H2,1-2H3
InChIKey SQNQIHWBJPWTEB-UHFFFAOYSA-N
Molecular Weight 267.343 g/mol
SMILES C1(N(CCC(C1)C)S(=O)(=O)c1ccc(cc1)C)=O
SPLASH splash10-0006-9000000000-91c22b35096217238572
Source of Spectrum F-68-9738-55
Synonyms 4-methyl-1-(p-tolylsulfonyl)piperidin-2-one 4-methyl-1-tosyl-2-piperidone 4-methyl-1-(4-methylphenyl)sulfonyl-2-piperidinone
Wiley ID 1573992