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3-((4-Fluorophenyl)ethynyl)-4-(thien-3-yl)pyridine
SpectraBase Compound ID ImYOjrTWtcp
InChI InChI=1S/C17H10FNS/c18-16-5-2-13(3-6-16)1-4-14-11-19-9-7-17(14)15-8-10-20-12-15/h2-3,5-12H
InChIKey COTWSFLQJZYDGV-UHFFFAOYSA-N
Mol Weight 279.33 g/mol
Molecular Formula C17H10FNS
Exact Mass 279.051799 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DrNF847QBKz
Name 3-((4-Fluorophenyl)ethynyl)-4-(thien-3-yl)pyridine
Appearance Yellow solid
Carrier Gas Helium
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H10FNS
InChI InChI=1S/C17H10FNS/c18-16-5-2-13(3-6-16)1-4-14-11-19-9-7-17(14)15-8-10-20-12-15/h2-3,5-12H
InChIKey COTWSFLQJZYDGV-UHFFFAOYSA-N
Instrument Name Finnigan MAT 95-XP
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.202101306
Molecular Weight 279.332 g/mol
Quality 342
Reported Formula C17H10NFS
SMILES C1(=CC=C(C=C1)F)C#CC=1C=NC=CC1C1=CSC=C1
SPLASH splash10-004i-0090000000-14389096744a847353b9
Source of Spectrum K1-2022-SM9-2c (DOI: 10.1002/ejoc.202101306)
Thin-Layer Chromatography 0.18 (Heptane/EtOAc, 5:1)
Wiley ID 1899014