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1-(4-((4-fluorophenyl)ethynyl)phenyl)ethanone
SpectraBase Compound ID JaHXrWcJJS1
InChI InChI=1S/C16H11FO/c1-12(18)15-8-4-13(5-9-15)2-3-14-6-10-16(17)11-7-14/h4-11H,1H3
InChIKey ITJKEFWUYKGOQQ-UHFFFAOYSA-N
Mol Weight 238.26 g/mol
Molecular Formula C16H11FO
Exact Mass 238.079393 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HJqQkXzBJoj
Name 1-(4-((4-fluorophenyl)ethynyl)phenyl)ethanone
Appearance Light yellow solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 238.079393136 u
Formula C16H11FO
InChI InChI=1S/C16H11FO/c1-12(18)15-8-4-13(5-9-15)2-3-14-6-10-16(17)11-7-14/h4-11H,1H3
InChIKey ITJKEFWUYKGOQQ-UHFFFAOYSA-N
Instrument Name Agilent Technologies 7000D
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.202200009
Molecular Weight 238.261 g/mol
Quality 443
SMILES C1=CC(C#CC=2C=CC(=CC2)F)=CC=C1C(=O)C
SPLASH splash10-00di-0590000000-dd113ce31a7e5df69170
Source of Spectrum K1-2022-SM65-Table 4, entry 5 (DOI: 10.1002/ejoc.202200009)
Wiley ID 1898477