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4'-[(4-Butylcyclohexyl)carbonyl][1,1'-biphenyl]-4-carbonitrile
SpectraBase Compound ID HbTC0fFT5FF
InChI InChI=1S/C24H27NO/c1-2-3-4-18-5-11-22(12-6-18)24(26)23-15-13-21(14-16-23)20-9-7-19(17-25)8-10-20/h7-10,13-16,18,22H,2-6,11-12H2,1H3
InChIKey KJJHBAQPJUVVCD-UHFFFAOYSA-N
Mol Weight 345.49 g/mol
Molecular Formula C24H27NO
Exact Mass 345.209264 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ft6Rmi80dCb
Name 4'-[(4-Butylcyclohexyl)carbonyl][1,1'-biphenyl]-4-carbonitrile
CAS Registry Number 132798-42-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H27NO
InChI InChI=1S/C24H27NO/c1-2-3-4-18-5-11-22(12-6-18)24(26)23-15-13-21(14-16-23)20-9-7-19(17-25)8-10-20/h7-10,13-16,18,22H,2-6,11-12H2,1H3
InChIKey KJJHBAQPJUVVCD-UHFFFAOYSA-N
Molecular Weight 345.486 g/mol
SMILES c1(ccc(cc1)C#N)-c1ccc(cc1)C(C1CCC(CC1)CCCC)=O
SPLASH splash10-0a4i-3391000000-404b50a5a4ba41e89c16
Source of Spectrum AD-0-2532-0
Synonyms 4-[4-(4-Butylcyclohexanecarbonyl)phenyl]benzonitrile 4-[4-(4-Butylcyclohexyl)carbonylphenyl]benzenecarbonitrile 4-[4-[(4-butylcyclohexyl)-oxomethyl]phenyl]benzonitrile Benzonitrile, 4-(4-butylcyclohexanoyl)phenyl-
Wiley ID 1423788