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4'-(Trifluoromethoxy)-[1,1'-biphenyl]-4-carbonitrile
SpectraBase Compound ID Koo9OGCSklv
InChI InChI=1S/C14H8F3NO/c15-14(16,17)19-13-7-5-12(6-8-13)11-3-1-10(9-18)2-4-11/h1-8H
InChIKey LDJNMSJDSXDKEN-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 FIJvfcPNDbj
Name 4'-(Trifluoromethoxy)-[1,1'-biphenyl]-4-carbonitrile
Appearance Colorless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 263.055798370 u
Formula C14H8F3NO
InChI InChI=1S/C14H8F3NO/c15-14(16,17)19-13-7-5-12(6-8-13)11-3-1-10(9-18)2-4-11/h1-8H
InChIKey LDJNMSJDSXDKEN-UHFFFAOYSA-N
Instrument Name Finnigan MAT 90 or JEOL JMS-700
Ionization Type EI positive ion
Literature Reference DOI 10.1002/chem.202005282
Molecular Weight 263.219 g/mol
Quality 15
SMILES C1(OC(F)(F)F)=CC=C(C=C1)C1=CC=C(C=C1)C#N
SPLASH splash10-03di-0790000000-3413d27ad3321412618a
Source of Spectrum QE-27-SM25-2ab (DOI: 10.1002/chem.202005282)
Thin-Layer Chromatography 0.3 (hexane/EtOAc, 96:4, UV, KMnO4)
Wiley ID 1901937