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4-(Trifluoromethyl)biphenyl
SpectraBase Compound ID Emxk7SmldLN
InChI InChI=1S/C13H9F3/c14-13(15,16)12-8-6-11(7-9-12)10-4-2-1-3-5-10/h1-9H
InChIKey OUMKBAHMPRLISR-UHFFFAOYSA-N
Mol Weight 222.21 g/mol
Molecular Formula C13H9F3
Exact Mass 222.065635 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2FmpBNj5LAk
Name 4-(Trifluoromethyl)-1,1'-biphenyl
Appearance White solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 222.065634779 u
Formula C13H9F3
InChI InChI=1S/C13H9F3/c14-13(15,16)12-8-6-11(7-9-12)10-4-2-1-3-5-10/h1-9H
InChIKey OUMKBAHMPRLISR-UHFFFAOYSA-N
Instrument Name Agilent Technologies 5975-7820A GC
Ionization Type EI
Literature Reference DOI 10.1002/anie.201800644
Molecular Weight 222.210 g/mol
Quality 320
SMILES C1=CC(=CC=C1)C1=CC=C(C=C1)C(F)(F)F
SPLASH splash10-00di-0290000000-4e654d8238f311be6a89
Source of Spectrum ACI-57-SM8-2a (DOI: 10.1002/anie.201800644)
Thin-Layer Chromatography 0.47 (hexane)
Wiley ID 1890625