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(+/-)-1-(4-Toluenesulfonyl)-pyrrolindine-3-carbonitrile
SpectraBase Compound ID I1CJN45lfFp
InChI InChI=1S/C12H14N2O2S/c1-10-2-4-12(5-3-10)17(15,16)14-7-6-11(8-13)9-14/h2-5,11H,6-7,9H2,1H3
InChIKey SLBBYRWJZAZOKF-UHFFFAOYSA-N
Mol Weight 250.32 g/mol
Molecular Formula C12H14N2O2S
Exact Mass 250.077599 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C1U3wXnaHsW
Name (+/-)-1-(4-Toluenesulfonyl)-pyrrolindine-3-carbonitrile
Alternate Name(s) 1-Tosylpyrrolidine-3-carbonitrile 1-(4-Methylphenyl)sulfonyl-3-pyrrolidinecarbonitrile 1-(p-tolylsulfonyl)pyrrolidine-3-carbonitrile 1-(4-Methylphenyl)sulfonylpyrrolidine-3-carbonitrile
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Formula C12H14N2O2S
InChI InChI=1S/C12H14N2O2S/c1-10-2-4-12(5-3-10)17(15,16)14-7-6-11(8-13)9-14/h2-5,11H,6-7,9H2,1H3
InChIKey SLBBYRWJZAZOKF-UHFFFAOYSA-N
Literature Reference DOI 10.1002/adsc.200700040
Molecular Weight 250.316 g/mol
SMILES C1N(CCC1C#N)S(=O)(c1ccc(cc1)C)=O
SPLASH splash10-052f-9530000000-955711fb68a0162baaea
Source of Spectrum ASC-349-1478-1a_Ts
Wiley ID 1765635