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2-Bromanyl-4-butyl-3-methyl-5-(4-methylphenyl)sulfonyl-1H-pyrrole
SpectraBase Compound ID 4G7phtOdQQw
InChI InChI=1S/C16H20BrNO2S/c1-4-5-6-14-12(3)15(17)18-16(14)21(19,20)13-9-7-11(2)8-10-13/h7-10,18H,4-6H2,1-3H3
InChIKey DGLPKAJFKKSNAF-UHFFFAOYSA-N
Mol Weight 370.31 g/mol
Molecular Formula C16H20BrNO2S
Exact Mass 369.039813 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BNpFCJGt17N
Name 2-Bromanyl-4-butyl-3-methyl-5-(4-methylphenyl)sulfonyl-1H-pyrrole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H20BrNO2S
InChI InChI=1S/C16H20BrNO2S/c1-4-5-6-14-12(3)15(17)18-16(14)21(19,20)13-9-7-11(2)8-10-13/h7-10,18H,4-6H2,1-3H3
InChIKey DGLPKAJFKKSNAF-UHFFFAOYSA-N
Molecular Weight 370.305 g/mol
SMILES [nH]1c(c(c(c1S(c1ccc(cc1)C)(=O)=O)CCCC)C)Br
SPLASH splash10-00di-1902000000-d9473300f9500778ee68
Source of Spectrum F-56-7880-11
Synonyms 2-Bromo-4-butyl-3-methyl-5-(p-tolylsulfonyl)-1H-pyrrole 2-Bromo-4-butyl-3-methyl-5-tosyl-1H-pyrrole
Wiley ID 858782