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5-{4-(Trifluoromethyl)phenyl}-2-(naphthalen-1-ylethynyl)oxazole
SpectraBase Compound ID 7CjYSLzMKVs
InChI InChI=1S/C22H12F3NO/c23-22(24,25)18-11-8-17(9-12-18)20-14-26-21(27-20)13-10-16-6-3-5-15-4-1-2-7-19(15)16/h1-9,11-12,14H
InChIKey XDTCWYNSXNGYHG-UHFFFAOYSA-N
Mol Weight 363.34 g/mol
Molecular Formula C22H12F3NO
Exact Mass 363.087098 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6KjKZnQO2up
Name 5-{4-(Trifluoromethyl)phenyl}-2-(naphthalen-1-ylethynyl)oxazole
Alternate Name(s) 2-(naphthalen-1-ylethynyl)-5-(4-(trifluoromethyl)phenyl)oxazole 2-[2-(1-naphthalenyl)ethynyl]-5-[4-(trifluoromethyl)phenyl]oxazole 2-(2-naphthalen-1-ylethynyl)-5-[4-(trifluoromethyl)phenyl]-1,3-oxazole
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Formula C22H12F3NO
InChI InChI=1S/C22H12F3NO/c23-22(24,25)18-11-8-17(9-12-18)20-14-26-21(27-20)13-10-16-6-3-5-15-4-1-2-7-19(15)16/h1-9,11-12,14H
InChIKey XDTCWYNSXNGYHG-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol300514d
Molecular Weight 363.339 g/mol
SMILES c1nc(oc1-c1ccc(C(F)(F)F)cc1)C#Cc1cccc2c1cccc2
SPLASH splash10-03di-0429000000-b9c461ed1a654bc22811
Source of Spectrum A1-14-1824/SMS14-5i
Wiley ID 1750182