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3-[(4-Chlorophenyl)ethynyl]-2-(propylthio)pyridine
SpectraBase Compound ID 28wDzdT8MP6
InChI InChI=1S/C16H14ClNS/c1-2-12-19-16-14(4-3-11-18-16)8-5-13-6-9-15(17)10-7-13/h3-4,6-7,9-11H,2,12H2,1H3
InChIKey RWOURYGSFCWHLS-UHFFFAOYSA-N
Mol Weight 287.81 g/mol
Molecular Formula C16H14ClNS
Exact Mass 287.053548 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1jAprbe6qZl
Name 3-[(4-Chlorophenyl)ethynyl]-2-(propylthio)pyridine
Appearance Brown oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H14ClNS
InChI InChI=1S/C16H14ClNS/c1-2-12-19-16-14(4-3-11-18-16)8-5-13-6-9-15(17)10-7-13/h3-4,6-7,9-11H,2,12H2,1H3
InChIKey RWOURYGSFCWHLS-UHFFFAOYSA-N
Instrument Name Shimadzu GC-MS QP2010
Ionization Type EI
Literature Reference DOI 10.1002/ajoc.202100102
Molecular Weight 287.808 g/mol
Reported Formula C16H14ClNS
SMILES c1(c(nccc1)SCCC)C#Cc1ccc(cc1)Cl
SPLASH splash10-0a4i-0190000000-2b1da62076a1a0cc14e7
Source of Spectrum AJO-10-SM5-1c
Wiley ID 1866339