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4-(2,3,5,6-tetrafluoro-4-heptyl-phenyl)benzonitrile
SpectraBase Compound ID D5eckEzAKSc
InChI InChI=1S/C20H19F4N/c1-2-3-4-5-6-7-15-17(21)19(23)16(20(24)18(15)22)14-10-8-13(12-25)9-11-14/h8-11H,2-7H2,1H3
InChIKey JHDNVVGOTHQZAW-UHFFFAOYSA-N
Mol Weight 349.37 g/mol
Molecular Formula C20H19F4N
Exact Mass 349.145362 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Kj8ZaIxHOXN
Name 4-(2,3,5,6-tetrafluoro-4-heptyl-phenyl)benzonitrile
CAS Registry Number 131895-00-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H19F4N
InChI InChI=1S/C20H19F4N/c1-2-3-4-5-6-7-15-17(21)19(23)16(20(24)18(15)22)14-10-8-13(12-25)9-11-14/h8-11H,2-7H2,1H3
InChIKey JHDNVVGOTHQZAW-UHFFFAOYSA-N
Molecular Weight 349.373 g/mol
SMILES c1(c(c(F)c(c(c1F)F)CCCCCCC)F)-c1ccc(C#N)cc1
SPLASH splash10-0hfy-6069000000-d23b19f8c35be52be153
Source of Spectrum F-46-7067-5
Synonyms 4-[2,3,5,6-tetrakis(fluoranyl)-4-heptyl-phenyl]benzenecarbonitrile
Wiley ID 1341411