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2-(2-Cyanoethyl)-1-tosylpyrrolidin-4-one
SpectraBase Compound ID K9dwvFmenxM
InChI InChI=1S/C14H16N2O3S/c1-11-4-6-14(7-5-11)20(18,19)16-10-13(17)9-12(16)3-2-8-15/h4-7,12H,2-3,9-10H2,1H3
InChIKey QIYPXQDSQFXHRC-UHFFFAOYSA-N
Mol Weight 292.35 g/mol
Molecular Formula C14H16N2O3S
Exact Mass 292.088164 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J5bVNQiwN2F
Name 2-(2-Cyanoethyl)-1-tosylpyrrolidin-4-one
Comments Less than 3 mono-isotopic peaks
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Formula C14H16N2O3S
InChI InChI=1S/C14H16N2O3S/c1-11-4-6-14(7-5-11)20(18,19)16-10-13(17)9-12(16)3-2-8-15/h4-7,12H,2-3,9-10H2,1H3
InChIKey QIYPXQDSQFXHRC-UHFFFAOYSA-N
Molecular Weight 292.353 g/mol
SMILES C1(N(CC(C1)=O)S(=O)(=O)c1ccc(C)cc1)CCC#N
SPLASH splash10-0a4i-0930000000-e6a1739ebdfe2f3adb5d
Source of Spectrum J-65-6301-13
Synonyms 3-{1-[(4-methylphenyl)sulfonyl]-4-oxo-2-pyrrolidinyl}propanenitrile
Wiley ID 1533289