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2-[[2-[(4-Fluorophenyl)ethynyl]benzyl]oxy]benzonitrile
SpectraBase Compound ID 4wJrekfinrN
InChI InChI=1S/C22H14FNO/c23-21-13-10-17(11-14-21)9-12-18-5-1-2-7-20(18)16-25-22-8-4-3-6-19(22)15-24/h1-8,10-11,13-14H,16H2
InChIKey MJXWMXJARWGTKK-UHFFFAOYSA-N
Mol Weight 327.36 g/mol
Molecular Formula C22H14FNO
Exact Mass 327.105942 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CvPc3wKzMxU
Name 2-[[2-[(4-Fluorophenyl)ethynyl]benzyl]oxy]benzonitrile
Alternate Name(s) 2-((2-((4-fluorophenyl)ethynyl)benzyl)oxy)benzonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H14FNO
InChI InChI=1S/C22H14FNO/c23-21-13-10-17(11-14-21)9-12-18-5-1-2-7-20(18)16-25-22-8-4-3-6-19(22)15-24/h1-8,10-11,13-14H,16H2
InChIKey MJXWMXJARWGTKK-UHFFFAOYSA-N
Molecular Weight 327.358 g/mol
SMILES C(c1c(cccc1)OCc1c(cccc1)C#Cc1ccc(cc1)F)#N
SPLASH splash10-0a4i-0390000000-a5e99b65917f90fe2c6f
Source of Spectrum J-80-10284-1i
Wiley ID 1801685