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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 4CF5o8ajIaM
Name BENZONITRILE, 2-FLUORO-4-(4'-PROPYL[1,1'-BICYCLOHEXYL]-4-YL)-
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. 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 327.2355
SMILES C(#N)c1c(F)cc(C2CCC(C3CCC(CCC)CC3)CC2)cc1
SPLASH splash10-00lr-9310000000-5ce760d7577d443f85e7
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany