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4-Methyl-2-[(4-methylphenyl)sulfonyl]-3-phenyl-1H-pyrrole
SpectraBase Compound ID IMCb4MpOZsu
InChI InChI=1S/C18H17NO2S/c1-13-8-10-16(11-9-13)22(20,21)18-17(14(2)12-19-18)15-6-4-3-5-7-15/h3-12,19H,1-2H3
InChIKey CVDXPWADTRTBIK-UHFFFAOYSA-N
Mol Weight 311.4 g/mol
Molecular Formula C18H17NO2S
Exact Mass 311.098 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HSu9NV8Ku15
Name 4-Methyl-2-[(4-methylphenyl)sulfonyl]-3-phenyl-1H-pyrrole
Alternate Name(s) 4-Methyl-3-phenyl-2-(p-tolylsulfonyl)-1H-pyrrole 4-Methyl-3-phenyl-2-tosyl-1H-pyrrole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H17NO2S
InChI InChI=1S/C18H17NO2S/c1-13-8-10-16(11-9-13)22(20,21)18-17(14(2)12-19-18)15-6-4-3-5-7-15/h3-12,19H,1-2H3
InChIKey CVDXPWADTRTBIK-UHFFFAOYSA-N
Molecular Weight 311.399 g/mol
SMILES [nH]1cc(c(c1S(=O)(=O)c1ccc(cc1)C)-c1ccccc1)C
SPLASH splash10-03di-0429000000-2cf35147908f536eb3f9
Source of Spectrum KC-57-7824-10
Wiley ID 1625682