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4-n-Butyl-4'-cyanobiphenyl
SpectraBase Compound ID IV9wemYPKqO
InChI InChI=1S/C17H17N/c1-2-3-4-14-5-9-16(10-6-14)17-11-7-15(13-18)8-12-17/h5-12H,2-4H2,1H3
InChIKey PJPLBHHDTUICNN-UHFFFAOYSA-N
Mol Weight 235.33 g/mol
Molecular Formula C17H17N
Exact Mass 235.1361 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DRLi7F5EkjA
Name 4'-butyl-[1,1'-biphenyl]-4-carbonitrile
Appearance White solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 235.136099551 u
Formula C17H17N
InChI InChI=1S/C17H17N/c1-2-3-4-14-5-9-16(10-6-14)17-11-7-15(13-18)8-12-17/h5-12H,2-4H2,1H3
InChIKey PJPLBHHDTUICNN-UHFFFAOYSA-N
Instrument Name GCMS-QP2010 Ultra
Ionization Type EI
Literature Reference DOI 10.1002/ajoc.202300094
Molecular Weight 235.330 g/mol
Quality 12
SMILES C(CCC)C1=CC=C(C=C1)C1=CC=C(C=C1)C#N
SPLASH splash10-0006-0940000000-5dd7abae007271ed8a0a
Source of Spectrum AJO-12-SM13-5u (DOI: 10.1002/ajoc.202300094)
Wiley ID 1909745