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1-(Toluene-4-sulfonyl)-piperidine-3-carboxylic acid
SpectraBase Compound ID IZJGr0w5L67
InChI InChI=1S/C13H17NO4S/c1-10-4-6-12(7-5-10)19(17,18)14-8-2-3-11(9-14)13(15)16/h4-7,11H,2-3,8-9H2,1H3,(H,15,16)
InChIKey IZPMTGWZPCZFNW-UHFFFAOYSA-N
Mol Weight 283.34 g/mol
Molecular Formula C13H17NO4S
Exact Mass 283.087829 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JaOQ31y6LMx
Name 1-(Toluene-4-sulfonyl)-piperidine-3-carboxylic acid
Alternate Name(s) 1-Tosylpiperidine-3-carboxylic acid 1-(4-Methylphenyl)sulfonyl-3-piperidinecarboxylic acid 1-(p-tolylsulfonyl)piperidine-3-carboxylic acid 1-(4-Methylphenyl)sulfonylpiperidine-3-carboxylic acid
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Formula C13H17NO4S
InChI InChI=1S/C13H17NO4S/c1-10-4-6-12(7-5-10)19(17,18)14-8-2-3-11(9-14)13(15)16/h4-7,11H,2-3,8-9H2,1H3,(H,15,16)
InChIKey IZPMTGWZPCZFNW-UHFFFAOYSA-N
Literature Reference DOI 10.1002/adsc.200700040
Molecular Weight 283.342 g/mol
SMILES OC(=O)C1CN(CCC1)S(=O)(=O)c1ccc(cc1)C
SPLASH splash10-000i-2290000000-d956c714f8600594389c
Source of Spectrum ASC-349-1479-3c_Ts
Wiley ID 1765648