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1-{6-Chloro-1-[(4-methylphenyl)sulfonyl]-1H-indol-2-yl}butan-2-one
SpectraBase Compound ID DnTLJ3EVVWR
InChI InChI=1S/C19H18ClNO3S/c1-3-17(22)12-16-10-14-6-7-15(20)11-19(14)21(16)25(23,24)18-8-4-13(2)5-9-18/h4-11H,3,12H2,1-2H3
InChIKey GQBVSBYEMCDLKI-UHFFFAOYSA-N
Mol Weight 375.87 g/mol
Molecular Formula C19H18ClNO3S
Exact Mass 375.069592 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2ovMYZostJj
Name 1-{6-Chloro-1-[(4-methylphenyl)sulfonyl]-1H-indol-2-yl}butan-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H18ClNO3S
InChI InChI=1S/C19H18ClNO3S/c1-3-17(22)12-16-10-14-6-7-15(20)11-19(14)21(16)25(23,24)18-8-4-13(2)5-9-18/h4-11H,3,12H2,1-2H3
InChIKey GQBVSBYEMCDLKI-UHFFFAOYSA-N
Molecular Weight 375.870 g/mol
SMILES c1([n](S(c2ccc(cc2)C)(=O)=O)c2c(c1)ccc(c2)Cl)CC(=O)CC
SPLASH splash10-0cfu-9436000000-8d1728f6c660f59efa8d
Source of Spectrum F-68-625-8d
Wiley ID 1707454