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3-{2'-[2''-(Trifluoromethyl)phenyl]ethynyl}-pyridine
SpectraBase Compound ID KEspE0144mB
InChI InChI=1S/C14H8F3N/c15-14(16,17)13-6-2-1-5-12(13)8-7-11-4-3-9-18-10-11/h1-6,9-10H
InChIKey WCFUDAIDOLYUQF-UHFFFAOYSA-N
Mol Weight 247.22 g/mol
Molecular Formula C14H8F3N
Exact Mass 247.060884 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ID2F0NM2iYm
Name 3-{2'-[2''-(Trifluoromethyl)phenyl]ethynyl}-pyridine
Comments Less than 3 mono-isotopic peaks
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Formula C14H8F3N
InChI InChI=1S/C14H8F3N/c15-14(16,17)13-6-2-1-5-12(13)8-7-11-4-3-9-18-10-11/h1-6,9-10H
InChIKey WCFUDAIDOLYUQF-UHFFFAOYSA-N
Molecular Weight 247.220 g/mol
SMILES C(c1c(C#Cc2cnccc2)cccc1)(F)(F)F
SPLASH splash10-0002-0090000000-c8e6a4d27d6ede78f0bd
Source of Spectrum QE-14-6998-Tbl-5/19
Wiley ID 1692288