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4-((2-fluorophenyl)ethynyl)phenol
SpectraBase Compound ID EBTZlvPu8MH
InChI InChI=1S/C14H9FO/c15-14-4-2-1-3-12(14)8-5-11-6-9-13(16)10-7-11/h1-4,6-7,9-10,16H
InChIKey RKLHYWHZPKAPAN-UHFFFAOYSA-N
Mol Weight 212.22 g/mol
Molecular Formula C14H9FO
Exact Mass 212.063743 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8JXGZENjk3l
Name 4-((2-fluorophenyl)ethynyl)phenol
Appearance Brown solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 212.063743072 u
Formula C14H9FO
InChI InChI=1S/C14H9FO/c15-14-4-2-1-3-12(14)8-5-11-6-9-13(16)10-7-11/h1-4,6-7,9-10,16H
InChIKey RKLHYWHZPKAPAN-UHFFFAOYSA-N
Instrument Name Joel JMS-700 or Bruker ApexQe hybrid 9.4 FT-ICR
Ionization Type EI Positive ion
Literature Reference DOI 10.1002/anie.201805918
Molecular Weight 212.223 g/mol
Quality 35
SMILES OC1=CC=C(C#CC2=C(F)C=CC=C2)C=C1
SPLASH splash10-03di-0290000000-76700a1e8ce179acc553
Source of Spectrum ACI-57-SM7-S1 (DOI: 10.1002/anie.201805918)
Thin-Layer Chromatography 0.34 (PE/EA, 5:1)
Wiley ID 1893459