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4-Cyano-4'-n-heptylbiphenyl

View entire compound with spectra: 6 NMR, 5 FTIR, 1 Raman, and 1 MS (GC)

4-Cyano-4'-n-heptylbiphenyl
SpectraBase Compound ID EDuLpojs2uS
InChI InChI=1S/C20H23N/c1-2-3-4-5-6-7-17-8-12-19(13-9-17)20-14-10-18(16-21)11-15-20/h8-15H,2-7H2,1H3
InChIKey ZGOWXOZNUNZPAV-UHFFFAOYSA-N
Mol Weight 277.41 g/mol
Molecular Formula C20H23N
Exact Mass 277.18305 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LYubfdjEyRI
Name [1,1'-Biphenyl]-4-carbonitrile, 4'-heptyl-
CAS Registry Number 41122-71-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H23N
InChI InChI=1S/C20H23N/c1-2-3-4-5-6-7-17-8-12-19(13-9-17)20-14-10-18(16-21)11-15-20/h8-15H,2-7H2,1H3
InChIKey ZGOWXOZNUNZPAV-UHFFFAOYSA-N
Molecular Weight 277.411 g/mol
SMILES CCCCCCCc1ccc(cc1)-c1ccc(C#N)cc1
SPLASH splash10-002f-1930000000-90dab8bb4424b39c57d8
Source of Spectrum JX-2015-2-824
Synonyms 4'-heptyl-[1,1'-biphenyl]-4-carbonitrile 4'-Heptyl-4-biphenylcarbonitrile 4'-Heptyl[1,1'-biphenyl]-4-carbonitrile 4-(4-Heptylphenyl)benzenecarbonitrile
Wiley ID 1722520