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2-[4-(Trifluoromethyl)phenyl]benzoxazole
SpectraBase Compound ID 7mbTLTIODM9
InChI InChI=1S/C14H8F3NO/c15-14(16,17)10-7-5-9(6-8-10)13-18-11-3-1-2-4-12(11)19-13/h1-8H
InChIKey PDDRXMHBYDEJQH-UHFFFAOYSA-N
Mol Weight 263.22 g/mol
Molecular Formula C14H8F3NO
Exact Mass 263.055798 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JHA44Ve20RR
Name 2-[4-(Trifluoromethyl)phenyl]benzoxazole
Appearance Colorless needles
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Exact Mass 263.055798370 u
Formula C14H8F3NO
InChI InChI=1S/C14H8F3NO/c15-14(16,17)10-7-5-9(6-8-10)13-18-11-3-1-2-4-12(11)19-13/h1-8H
InChIKey PDDRXMHBYDEJQH-UHFFFAOYSA-N
Instrument Name Agilent 5977E Diff-SST MSD-230V
Ionization Type EI
Literature Reference DOI 10.3762/bjoc.18.155
Molecular Weight 263.219 g/mol
Quality 178
Reported Formula C14H8F3NO
SMILES C=1C=CC=2OC(C=3C=CC(C(F)(F)F)=CC3)=NC2C1
SPLASH splash10-03di-1090000000-2a1a9fa821a998f513cf
Source of Spectrum BJO-18-SM3-8f (DOI: 10.3762/bjoc.18.155)
Wiley ID 1901246