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2-(Propylthio)-3-(4-tolylethynyl)pyridine
SpectraBase Compound ID 6zTdPKYBq11
InChI InChI=1S/C17H17NS/c1-3-13-19-17-16(5-4-12-18-17)11-10-15-8-6-14(2)7-9-15/h4-9,12H,3,13H2,1-2H3
InChIKey JPRUEMFTCJNBJZ-UHFFFAOYSA-N
Mol Weight 267.39 g/mol
Molecular Formula C17H17NS
Exact Mass 267.108171 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HXVvebpG9h7
Name 2-(Propylthio)-3-(4-tolylethynyl)pyridine
Appearance Orange oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H17NS
InChI InChI=1S/C17H17NS/c1-3-13-19-17-16(5-4-12-18-17)11-10-15-8-6-14(2)7-9-15/h4-9,12H,3,13H2,1-2H3
InChIKey JPRUEMFTCJNBJZ-UHFFFAOYSA-N
Instrument Name Shimadzu GC-MS QP2010
Ionization Type EI
Literature Reference DOI 10.1002/ajoc.202100102
Molecular Weight 267.390 g/mol
Reported Formula C17H17NS
SMILES c1(c(nccc1)SCCC)C#Cc1ccc(cc1)C
SPLASH splash10-00ri-0090000000-eef709cda4d5f083cdfc
Source of Spectrum AJO-10-SM5-1b
Wiley ID 1866338