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1-(4-Methylphenyl)-3-{1-[(4-methylphenyl)sulfonyl]-1H-indol-2-yl}acetone
SpectraBase Compound ID IrqdbkyTLOq
InChI InChI=1S/C25H23NO3S/c1-18-7-11-20(12-8-18)15-23(27)17-22-16-21-5-3-4-6-25(21)26(22)30(28,29)24-13-9-19(2)10-14-24/h3-14,16H,15,17H2,1-2H3
InChIKey IBTHTQDIPTWMEV-UHFFFAOYSA-N
Mol Weight 417.52 g/mol
Molecular Formula C25H23NO3S
Exact Mass 417.139865 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9GwJZA5YVhb
Name 1-(4-Methylphenyl)-3-{1-[(4-methylphenyl)sulfonyl]-1H-indol-2-yl}acetone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H23NO3S
InChI InChI=1S/C25H23NO3S/c1-18-7-11-20(12-8-18)15-23(27)17-22-16-21-5-3-4-6-25(21)26(22)30(28,29)24-13-9-19(2)10-14-24/h3-14,16H,15,17H2,1-2H3
InChIKey IBTHTQDIPTWMEV-UHFFFAOYSA-N
Molecular Weight 417.523 g/mol
SMILES c1([n](S(c2ccc(cc2)C)(=O)=O)c2c(c1)cccc2)CC(=O)Cc1ccc(cc1)C
SPLASH splash10-05ai-5960000000-bdb6139ad1a23f2566f3
Source of Spectrum F-68-625-8h
Wiley ID 1707450