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2-(Benzylthio)-3-(phenylethynyl)pyridine
SpectraBase Compound ID AA64SgCqNEx
InChI InChI=1S/C20H15NS/c1-3-8-17(9-4-1)13-14-19-12-7-15-21-20(19)22-16-18-10-5-2-6-11-18/h1-12,15H,16H2
InChIKey PGUSPMGRTPIWLA-UHFFFAOYSA-N
Mol Weight 301.41 g/mol
Molecular Formula C20H15NS
Exact Mass 301.092521 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID H5JsVUd2w1N
Name 2-(Benzylthio)-3-(phenylethynyl)pyridine
Appearance Brown oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H15NS
InChI InChI=1S/C20H15NS/c1-3-8-17(9-4-1)13-14-19-12-7-15-21-20(19)22-16-18-10-5-2-6-11-18/h1-12,15H,16H2
InChIKey PGUSPMGRTPIWLA-UHFFFAOYSA-N
Instrument Name Shimadzu GC-MS QP2010
Ionization Type EI
Literature Reference DOI 10.1002/ajoc.202100102
Molecular Weight 301.407 g/mol
Reported Formula C20H15NS
SMILES c1(c(nccc1)SCc1ccccc1)C#Cc1ccccc1
SPLASH splash10-00di-0292000000-fb4d23897365f3026c34
Source of Spectrum AJO-10-SM7-1h
Wiley ID 1866344