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3-Methyl-4-phenylsulfonyl-2-tosylpyrrole
SpectraBase Compound ID A6Sb9T5LfJ
InChI InChI=1S/C18H17NO4S2/c1-13-8-10-16(11-9-13)25(22,23)18-14(2)17(12-19-18)24(20,21)15-6-4-3-5-7-15/h3-12,19H,1-2H3
InChIKey PNKOIATUZFKVEO-UHFFFAOYSA-N
Mol Weight 375.46 g/mol
Molecular Formula C18H17NO4S2
Exact Mass 375.0599 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6HkkPpjIxw6
Name 3-Methyl-4-phenylsulfonyl-2-tosylpyrrole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H17NO4S2
InChI InChI=1S/C18H17NO4S2/c1-13-8-10-16(11-9-13)25(22,23)18-14(2)17(12-19-18)24(20,21)15-6-4-3-5-7-15/h3-12,19H,1-2H3
InChIKey PNKOIATUZFKVEO-UHFFFAOYSA-N
Molecular Weight 375.457 g/mol
SMILES [nH]1cc(c(c1S(=O)(=O)c1ccc(C)cc1)C)S(=O)(=O)c1ccccc1
SPLASH splash10-004i-0209000000-a102f45b7b833cf168b2
Source of Spectrum AJ-67-1447-13
Synonyms 3-Methyl-2-[(4-methylphenyl)sulfonyl]-4-(phenylsulfonyl)-1H-pyrrole
Wiley ID 772613