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(rac)-3-(4-Phenylbutan-2-ylthio)pyridine
SpectraBase Compound ID 5g0ew5rNDql
InChI InChI=1S/C15H17NS/c1-13(17-15-8-5-11-16-12-15)9-10-14-6-3-2-4-7-14/h2-8,11-13H,9-10H2,1H3
InChIKey WCQASUOWYMEUDE-UHFFFAOYSA-N
Mol Weight 243.37 g/mol
Molecular Formula C15H17NS
Exact Mass 243.108171 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6T1cKo1pbmF
Name (rac)-3-(4-Phenylbutan-2-ylthio)pyridine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H17NS
InChI InChI=1S/C15H17NS/c1-13(17-15-8-5-11-16-12-15)9-10-14-6-3-2-4-7-14/h2-8,11-13H,9-10H2,1H3
InChIKey WCQASUOWYMEUDE-UHFFFAOYSA-N
Literature Reference DOI 10.1021/jo402246h
Molecular Weight 243.368 g/mol
SMILES c1cc(ccc1)CCC(Sc1cnccc1)C
SPLASH splash10-0006-9550000000-59d76d1ecacedd231259
Source of Spectrum J-78-12609-3f
Synonyms 3-((4-phenylbutan-2-yl)thio)pyridine
Wiley ID 1747386