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3-(Phenylethynyl)-2-(propylthio)pyridine
SpectraBase Compound ID GO9IyhDyzqJ
InChI InChI=1S/C16H15NS/c1-2-13-18-16-15(9-6-12-17-16)11-10-14-7-4-3-5-8-14/h3-9,12H,2,13H2,1H3
InChIKey RYPAMGHUIUZFOU-UHFFFAOYSA-N
Mol Weight 253.36 g/mol
Molecular Formula C16H15NS
Exact Mass 253.092521 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3rswSkYWXnr
Name 3-(Phenylethynyl)-2-(propylthio)pyridine
Appearance Brown oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H15NS
InChI InChI=1S/C16H15NS/c1-2-13-18-16-15(9-6-12-17-16)11-10-14-7-4-3-5-8-14/h3-9,12H,2,13H2,1H3
InChIKey RYPAMGHUIUZFOU-UHFFFAOYSA-N
Instrument Name Shimadzu GC-MS QP2010
Ionization Type EI
Literature Reference DOI 10.1002/ajoc.202100102
Molecular Weight 253.363 g/mol
Reported Formula C16H15NS
SMILES c1(c(nccc1)SCCC)C#Cc1ccccc1
SPLASH splash10-0229-0190000000-96c75bda633c92052f9d
Source of Spectrum AJO-10-SM4-1a
Wiley ID 1866337