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1H-Indole, 3-[[(4-methylphenyl)sulfonyl]methyl]-
SpectraBase Compound ID Gjt8Dffm8CR
InChI InChI=1S/C16H15NO2S/c1-12-6-8-14(9-7-12)20(18,19)11-13-10-17-16-5-3-2-4-15(13)16/h2-10,17H,11H2,1H3
InChIKey JQEYIILBFDIPIW-UHFFFAOYSA-N
Mol Weight 285.36 g/mol
Molecular Formula C16H15NO2S
Exact Mass 285.08235 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Fpbl48PXwtz
Name 1H-Indole, 3-[[(4-methylphenyl)sulfonyl]methyl]-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H15NO2S
InChI InChI=1S/C16H15NO2S/c1-12-6-8-14(9-7-12)20(18,19)11-13-10-17-16-5-3-2-4-15(13)16/h2-10,17H,11H2,1H3
InChIKey JQEYIILBFDIPIW-UHFFFAOYSA-N
Molecular Weight 285.361 g/mol
SMILES [nH]1c2c(c(c1)CS(c1ccc(cc1)C)(=O)=O)cccc2
SPLASH splash10-001i-6900000000-1e5cf5c123745d1959d0
Source of Spectrum IY-2-4704-3
Synonyms 3-(p-tolylsulfonylmethyl)-1H-indole 3-[(4-methylphenyl)sulfonylmethyl]-1H-indole
Wiley ID 1655026