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2-(p-tolylsulfonyl)-1H-pyrrole
SpectraBase Compound ID IADXQeGXF6
InChI InChI=1S/C11H11NO2S/c1-9-4-6-10(7-5-9)15(13,14)11-3-2-8-12-11/h2-8,12H,1H3
InChIKey NQTVFNSSDCHPJF-UHFFFAOYSA-N
Mol Weight 221.27 g/mol
Molecular Formula C11H11NO2S
Exact Mass 221.05105 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L5UW7Z28jDi
Name 2-(p-tolylsulfonyl)-1H-pyrrole
Alternate Name(s) 2-tosyl-1H-pyrrole
Comments Less than 3 mono-isotopic peaks
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Formula C11H11NO2S
InChI InChI=1S/C11H11NO2S/c1-9-4-6-10(7-5-9)15(13,14)11-3-2-8-12-11/h2-8,12H,1H3
InChIKey NQTVFNSSDCHPJF-UHFFFAOYSA-N
Molecular Weight 221.274 g/mol
SMILES [nH]1cccc1S(c1ccc(cc1)C)(=O)=O
SPLASH splash10-00di-0290000000-4dc597f15e315e7b9321
Source of Spectrum H1-48-158-4
Wiley ID 816236