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(+/-)-1-(4-Toluenesulfonyl)-piperidine-2-carbonitrile
SpectraBase Compound ID C9vbwwDz8iI
InChI InChI=1S/C13H16N2O2S/c1-11-5-7-13(8-6-11)18(16,17)15-9-3-2-4-12(15)10-14/h5-8,12H,2-4,9H2,1H3
InChIKey KDJSGKDFAPNUQZ-UHFFFAOYSA-N
Mol Weight 264.34 g/mol
Molecular Formula C13H16N2O2S
Exact Mass 264.093249 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4ZsDbzkTv81
Name (+/-)-1-(4-Toluenesulfonyl)-piperidine-2-carbonitrile
Alternate Name(s) 1-Tosylpiperidine-2-carbonitrile 1-(4-Methylphenyl)sulfonyl-2-piperidinecarbonitrile 1-(p-tolylsulfonyl)piperidine-2-carbonitrile 1-(4-Methylphenyl)sulfonylpiperidine-2-carbonitrile
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Formula C13H16N2O2S
InChI InChI=1S/C13H16N2O2S/c1-11-5-7-13(8-6-11)18(16,17)15-9-3-2-4-12(15)10-14/h5-8,12H,2-4,9H2,1H3
InChIKey KDJSGKDFAPNUQZ-UHFFFAOYSA-N
Literature Reference DOI 10.1002/adsc.200700040
Molecular Weight 264.343 g/mol
SMILES C1(N(CCCC1)S(=O)(=O)c1ccc(cc1)C)C#N
SPLASH splash10-08fu-6690000000-0be232267ea933c624f1
Source of Spectrum ASC-349-1479-4a_Ts
Wiley ID 1765650