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[4-(4-Chloro-2-phenylethynylbenzenesulfinyl)phenyl]dimethylamine
SpectraBase Compound ID 8HuKRzpNRZq
InChI InChI=1S/C22H18FNOS/c1-24(2)20-11-13-21(14-12-20)26(25)22-15-10-19(23)16-18(22)9-8-17-6-4-3-5-7-17/h3-7,10-16H,1-2H3
InChIKey ROCVNBFQAFXOPX-UHFFFAOYSA-N
Mol Weight 363.45 g/mol
Molecular Formula C22H18FNOS
Exact Mass 363.109314 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KbNoFI77BzY
Name [4-(4-Chloro-2-phenylethynylbenzenesulfinyl)phenyl]dimethylamine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H18FNOS
InChI InChI=1S/C22H18FNOS/c1-24(2)20-11-13-21(14-12-20)26(25)22-15-10-19(23)16-18(22)9-8-17-6-4-3-5-7-17/h3-7,10-16H,1-2H3
InChIKey ROCVNBFQAFXOPX-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol801431z
Molecular Weight 363.450 g/mol
SMILES c1c(F)ccc(S(=O)c2ccc(N(C)C)cc2)c1C#Cc1ccccc1
SPLASH splash10-0a4i-0294000000-f596f838fbaece655879
Source of Spectrum A1-10-3891/SM10-3d
Synonyms 4-((4-fluoro-2-(phenylethynyl)phenyl)sulfinyl)-N,N-dimethylaniline
Wiley ID 1759720