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2-Fluoranyl-4-[4-(4-propylcyclohexyl)cyclohexyl]benzenecarbonitrile
SpectraBase Compound ID CBy3Z65sZWg
InChI InChI=1S/C22H30FN/c1-2-3-16-4-6-17(7-5-16)18-8-10-19(11-9-18)20-12-13-21(15-24)22(23)14-20/h12-14,16-19H,2-11H2,1H3
InChIKey GMUPOLFWZIYWQO-UHFFFAOYSA-N
Mol Weight 327.49 g/mol
Molecular Formula C22H30FN
Exact Mass 327.236228 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 569Qmyz8YoF
Name 2-Fluoranyl-4-[4-(4-propylcyclohexyl)cyclohexyl]benzenecarbonitrile
CAS Registry Number 93743-04-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H30FN
InChI InChI=1S/C22H30FN/c1-2-3-16-4-6-17(7-5-16)18-8-10-19(11-9-18)20-12-13-21(15-24)22(23)14-20/h12-14,16-19H,2-11H2,1H3
InChIKey GMUPOLFWZIYWQO-UHFFFAOYSA-N
Molecular Weight 327.487 g/mol
SMILES c1(F)cc(ccc1C#N)C1CCC(CC1)C1CCC(CC1)CCC
SPLASH splash10-02t9-9401000000-6ea3ae3fa9b657c63302
Source of Spectrum O-25-552-16
Synonyms 2-Fluoro-4-[4-(4-propylcyclohexyl)cyclohexyl]benzonitrile Benzonitrile, 2-fluoro-4-(4'-propyl[1,1'-bicyclohexyl]-4-yl)-
Wiley ID 1325759