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4-(4-butyl-2,3,5,6-tetrafluoro-phenyl)benzonitrile
SpectraBase Compound ID 2Zkl3tsoYFY
InChI InChI=1S/C17H13F4N/c1-2-3-4-12-14(18)16(20)13(17(21)15(12)19)11-7-5-10(9-22)6-8-11/h5-8H,2-4H2,1H3
InChIKey JVBKBFHICDFPBN-UHFFFAOYSA-N
Mol Weight 307.29 g/mol
Molecular Formula C17H13F4N
Exact Mass 307.098412 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FykI8HpBcPw
Name 4-(4-butyl-2,3,5,6-tetrafluoro-phenyl)benzonitrile
CAS Registry Number 131894-94-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H13F4N
InChI InChI=1S/C17H13F4N/c1-2-3-4-12-14(18)16(20)13(17(21)15(12)19)11-7-5-10(9-22)6-8-11/h5-8H,2-4H2,1H3
InChIKey JVBKBFHICDFPBN-UHFFFAOYSA-N
Molecular Weight 307.292 g/mol
SMILES c1(c(c(F)c(c(c1F)F)CCCC)F)-c1ccc(C#N)cc1
SPLASH splash10-0006-9034000000-18c2880f7fc12b1f5e26
Source of Spectrum F-46-7065-5
Synonyms 4-[4-butyl-2,3,5,6-tetrakis(fluoranyl)phenyl]benzenecarbonitrile
Wiley ID 1308943