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1-(4-Toluenesulfonyl)-pyrrolindine-3-carboxylic acid
SpectraBase Compound ID 4ximt57uBP0
InChI InChI=1S/C12H15NO4S/c1-9-2-4-11(5-3-9)18(16,17)13-7-6-10(8-13)12(14)15/h2-5,10H,6-8H2,1H3,(H,14,15)
InChIKey BXNILIMAZBNUFH-UHFFFAOYSA-N
Mol Weight 269.31 g/mol
Molecular Formula C12H15NO4S
Exact Mass 269.072179 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3MwrC7t9MaS
Name 1-(4-Toluenesulfonyl)-pyrrolindine-3-carboxylic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H15NO4S
InChI InChI=1S/C12H15NO4S/c1-9-2-4-11(5-3-9)18(16,17)13-7-6-10(8-13)12(14)15/h2-5,10H,6-8H2,1H3,(H,14,15)
InChIKey BXNILIMAZBNUFH-UHFFFAOYSA-N
Literature Reference DOI 10.1002/adsc.200700040
Molecular Weight 269.315 g/mol
SMILES OC(C1CCN(S(=O)(c2ccc(cc2)C)=O)C1)=O
SPLASH splash10-01pc-5970000000-20346a0e4ae0cfdc3fea
Source of Spectrum ASC-349-1478-1c_Ts
Synonyms 1-Tosylpyrrolidine-3-carboxylic acid 1-(4-Methylphenyl)sulfonyl-3-pyrrolidinecarboxylic acid 1-(p-tolylsulfonyl)pyrrolidine-3-carboxylic acid 1-(4-Methylphenyl)sulfonylpyrrolidine-3-carboxylic acid
Wiley ID 1765638