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1-Butyl-4-[(4-ethylphenyl)ethynyl]benzene
SpectraBase Compound ID 1iUe3OQ7KZZ
InChI InChI=1S/C20H22/c1-3-5-6-18-11-13-20(14-12-18)16-15-19-9-7-17(4-2)8-10-19/h7-14H,3-6H2,1-2H3
InChIKey FEWCQIVPFKPBDH-UHFFFAOYSA-N
Mol Weight 262.4 g/mol
Molecular Formula C20H22
Exact Mass 262.172151 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2EfgUPx9qzn
Name 1-Butyl-4-[(4-ethylphenyl)ethynyl]benzene
Alternate Name(s) 1-Butyl-4-[2-(4-ethylphenyl)ethynyl]benzene Benzene, 1-butyl-4-[(4-ethylphenyl)ethynyl]-
CAS Registry Number 117392-63-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H22
InChI InChI=1S/C20H22/c1-3-5-6-18-11-13-20(14-12-18)16-15-19-9-7-17(4-2)8-10-19/h7-14H,3-6H2,1-2H3
InChIKey FEWCQIVPFKPBDH-UHFFFAOYSA-N
Molecular Weight 262.396 g/mol
SMILES c1c(ccc(C#Cc2ccc(CC)cc2)c1)CCCC
SPLASH splash10-0i00-0190000000-8005c9b0818a14f0d397
Source of Spectrum O-26-140-2
Wiley ID 1266576