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Cyclohexanecarbonitrile, 1-methyl-4-[2-(4'-pentyl[1,1'-biphenyl]-4-yl)ethyl]-
SpectraBase Compound ID G4P9Lwt5p4v
InChI InChI=1S/C27H35N/c1-3-4-5-6-22-9-13-25(14-10-22)26-15-11-23(12-16-26)7-8-24-17-19-27(2,21-28)20-18-24/h9-16,24H,3-8,17-20H2,1-2H3
InChIKey JFNYRUQFKQJFHY-UHFFFAOYSA-N
Mol Weight 373.6 g/mol
Molecular Formula C27H35N
Exact Mass 373.27695 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HfPLOgdWUfx
Name Cyclohexanecarbonitrile, 1-methyl-4-[2-(4'-pentyl[1,1'-biphenyl]-4-yl)ethyl]-
CAS Registry Number 132333-39-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H35N
InChI InChI=1S/C27H35N/c1-3-4-5-6-22-9-13-25(14-10-22)26-15-11-23(12-16-26)7-8-24-17-19-27(2,21-28)20-18-24/h9-16,24H,3-8,17-20H2,1-2H3
InChIKey JFNYRUQFKQJFHY-UHFFFAOYSA-N
Molecular Weight 373.584 g/mol
SMILES C1C(CCC(CCc2ccc(-c3ccc(CCCCC)cc3)cc2)C1)(C)C#N
SPLASH splash10-01b9-0109000000-541a69798c5818f29a72
Source of Spectrum O-25-683-10
Synonyms 1-Methyl-4-[2-(4'-pentyl[1,1'-biphenyl]-4-yl)ethyl]cyclohexanecarbonitrile 1-Methyl-4-[2-[4-(4-pentylphenyl)phenyl]ethyl]-1-cyclohexanecarbonitrile 1-Methyl-4-[2-[4-(4-pentylphenyl)phenyl]ethyl]cyclohexane-1-carbonitrile 1-Methyl-4-[2-[4-(4-pentylphenyl)phenyl]ethyl]cyclohexanecarbonitrile 4-[2-[4-(4-amylphenyl)phenyl]ethyl]-1-methyl-cyclohexanecarbonitrile
Wiley ID 1356255