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1-[5-Acetyl-1-(toluene-4-sulfonyl)-1H-pyrrol-3-yl]ethanone
SpectraBase Compound ID 32CIvqdsRJZ
InChI InChI=1S/C15H15NO4S/c1-10-4-6-14(7-5-10)21(19,20)16-9-13(11(2)17)8-15(16)12(3)18/h4-9H,1-3H3
InChIKey QQKYXQGJCZKBNE-UHFFFAOYSA-N
Mol Weight 305.35 g/mol
Molecular Formula C15H15NO4S
Exact Mass 305.072179 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GIU6yhqtaRt
Name 1-[5-Acetyl-1-(toluene-4-sulfonyl)-1H-pyrrol-3-yl]ethanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H15NO4S
InChI InChI=1S/C15H15NO4S/c1-10-4-6-14(7-5-10)21(19,20)16-9-13(11(2)17)8-15(16)12(3)18/h4-9H,1-3H3
InChIKey QQKYXQGJCZKBNE-UHFFFAOYSA-N
Molecular Weight 305.348 g/mol
SMILES C(C)(c1c[n](c(c1)C(=O)C)S(=O)(=O)c1ccc(cc1)C)=O
SPLASH splash10-0006-9330000000-41af37b9285571084bc9
Source of Spectrum KC-61-7911-15
Synonyms 1-{4-acetyl-1-[(4-methylphenyl)sulfonyl]-1H-pyrrol-2-yl}ethanone 1-[4-acetyl-1-(4-methylphenyl)sulfonyl-2-pyrrolyl]ethanone 1-[4-acetyl-1-(4-methylphenyl)sulfonylpyrrol-2-yl]ethanone 1-[4-acetyl-1-(p-tolylsulfonyl)pyrrol-2-yl]ethanone 1-[4-ethanoyl-1-(4-methylphenyl)sulfonyl-pyrrol-2-yl]ethanone
Wiley ID 1630175