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2,2,2-trifluoro-1-[4-[4-(2-phenylethynyl)phenoxy]phenyl]ethanone
SpectraBase Compound ID BcrqqlNwxeT
InChI InChI=1S/C22H13F3O2/c23-22(24,25)21(26)18-10-14-20(15-11-18)27-19-12-8-17(9-13-19)7-6-16-4-2-1-3-5-16/h1-5,8-15H
InChIKey CKROUNQIGQYODR-UHFFFAOYSA-N
Mol Weight 366.34 g/mol
Molecular Formula C22H13F3O2
Exact Mass 366.086764 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9act8lk2oCj
Name 2,2,2-trifluoro-1-[4-[4-(2-phenylethynyl)phenoxy]phenyl]ethanone
Alternate Name(s) 2,2,2-tris(fluoranyl)-1-[4-[4-(2-phenylethynyl)phenoxy]phenyl]ethanone
Comments Less than 3 mono-isotopic peaks
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Formula C22H13F3O2
InChI InChI=1S/C22H13F3O2/c23-22(24,25)21(26)18-10-14-20(15-11-18)27-19-12-8-17(9-13-19)7-6-16-4-2-1-3-5-16/h1-5,8-15H
InChIKey CKROUNQIGQYODR-UHFFFAOYSA-N
Molecular Weight 366.339 g/mol
SMILES C(C(c1ccc(Oc2ccc(C#Cc3ccccc3)cc2)cc1)=O)(F)(F)F
SPLASH splash10-0002-0094000000-fabb50b73840c7d697ac
Source of Spectrum J-59-2510-19
Wiley ID 1352106