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2-[2-(4-fluorophenyl)ethynyl]aniline
SpectraBase Compound ID HZGgt5TIFjk
InChI InChI=1S/C14H10FN/c15-13-9-6-11(7-10-13)5-8-12-3-1-2-4-14(12)16/h1-4,6-7,9-10H,16H2
InChIKey TUKBDCKEFZMYLE-UHFFFAOYSA-N
Mol Weight 211.24 g/mol
Molecular Formula C14H10FN
Exact Mass 211.079727 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID H01qhi2a7pv
Name 2-[2-(4-fluorophenyl)ethynyl]aniline
Appearance Orange solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 211.079727489 u
Formula C14H10FN
InChI InChI=1S/C14H10FN/c15-13-9-6-11(7-10-13)5-8-12-3-1-2-4-14(12)16/h1-4,6-7,9-10H,16H2
InChIKey TUKBDCKEFZMYLE-UHFFFAOYSA-N
Instrument Name Finnigan MAT 95
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.202201132
Molecular Weight 211.239 g/mol
Quality 92
Reported Formula C14H10FN
SMILES NC1=C(C#CC2=CC=C(F)C=C2)C=CC=C1
SPLASH splash10-03e9-0690000000-cd0ed0cb1e35d8aa2106
Source of Spectrum K1-26-SM11-11b (DOI: 10.1002/ejoc.202201132)
Thin-Layer Chromatography 0.55 (cHex/EtOAc, 4:1)
Wiley ID 1910466