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2-Fluoro-4-(4-pentylcyclohexyl)benzonitrile
SpectraBase Compound ID CJ7UGy7CrvM
InChI InChI=1S/C18H24FN/c1-2-3-4-5-14-6-8-15(9-7-14)16-10-11-17(13-20)18(19)12-16/h10-12,14-15H,2-9H2,1H3
InChIKey OMMGVKXMWFSMJV-UHFFFAOYSA-N
Mol Weight 273.4 g/mol
Molecular Formula C18H24FN
Exact Mass 273.189278 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ELBNmvvOTMI
Name 2-Fluoro-4-(4-pentylcyclohexyl)benzonitrile
CAS Registry Number 85896-79-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H24FN
InChI InChI=1S/C18H24FN/c1-2-3-4-5-14-6-8-15(9-7-14)16-10-11-17(13-20)18(19)12-16/h10-12,14-15H,2-9H2,1H3
InChIKey OMMGVKXMWFSMJV-UHFFFAOYSA-N
Molecular Weight 273.395 g/mol
SMILES c1(F)cc(ccc1C#N)C1CCC(CC1)CCCCC
SPLASH splash10-000t-7910000000-3b3014a5acc33b480a80
Source of Spectrum O-25-551-6
Synonyms 2-Fluoranyl-4-(4-pentylcyclohexyl)benzenecarbonitrile 4-(4-amylcyclohexyl)-2-fluoro-benzonitrile Benzonitrile, 2-fluoro-4-(4-pentylcyclohexyl)-
Wiley ID 1277451