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4-(2,3,5,6-tetrafluoro-4-octyl-phenyl)benzonitrile
SpectraBase Compound ID C2dYiowIgep
InChI InChI=1S/C21H21F4N/c1-2-3-4-5-6-7-8-16-18(22)20(24)17(21(25)19(16)23)15-11-9-14(13-26)10-12-15/h9-12H,2-8H2,1H3
InChIKey OITVUDMWAQJDTF-UHFFFAOYSA-N
Mol Weight 363.4 g/mol
Molecular Formula C21H21F4N
Exact Mass 363.161012 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1NJ4rfogA2i
Name 4-(2,3,5,6-tetrafluoro-4-octyl-phenyl)benzonitrile
CAS Registry Number 131895-02-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H21F4N
InChI InChI=1S/C21H21F4N/c1-2-3-4-5-6-7-8-16-18(22)20(24)17(21(25)19(16)23)15-11-9-14(13-26)10-12-15/h9-12H,2-8H2,1H3
InChIKey OITVUDMWAQJDTF-UHFFFAOYSA-N
Molecular Weight 363.400 g/mol
SMILES c1(c(c(F)c(c(c1F)F)CCCCCCCC)F)-c1ccc(C#N)cc1
SPLASH splash10-08fu-9033000000-bf641480b2c70947332d
Source of Spectrum F-46-7067-5
Synonyms 4-[2,3,5,6-tetrakis(fluoranyl)-4-octyl-phenyl]benzenecarbonitrile
Wiley ID 1350285