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4'-chloro-4-fluoro-1,1':3',1''-terphenyl
SpectraBase Compound ID 8KPGqMUWLZ6
InChI InChI=1S/C18H12ClF/c19-18-11-8-15(13-6-9-16(20)10-7-13)12-17(18)14-4-2-1-3-5-14/h1-12H
InChIKey XKGVNVHHCAIRRO-UHFFFAOYSA-N
Mol Weight 282.75 g/mol
Molecular Formula C18H12ClF
Exact Mass 282.061156 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5yu8LTdX1F1
Name 4'-chloro-4-fluoro-1,1':3',1''-terphenyl
Appearance Colorless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H12ClF
InChI InChI=1S/C18H12ClF/c19-18-11-8-15(13-6-9-16(20)10-7-13)12-17(18)14-4-2-1-3-5-14/h1-12H
InChIKey XKGVNVHHCAIRRO-UHFFFAOYSA-N
Instrument Name Agilent Technologies 5975-7820A
Ionization Type EI
Literature Reference DOI 10.1002/anie.201911465
Molecular Weight 282.745 g/mol
Reported Formula C18H12(35)ClF
SMILES c1c(Cl)c(cc(c1)-c1ccc(cc1)F)-c1ccccc1
SPLASH splash10-000t-0090000000-9f91d16a5f2176cfd415
Source of Spectrum ACI-59-SM15-24
Thin-Layer Chromatography Rf = 0.53 (Pentane)
Wiley ID 1856886