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1-Ethyl-4-[(4-pentylphenyl)ethynyl]benzene
SpectraBase Compound ID IbPeZ3xs0i8
InChI InChI=1S/C21H24/c1-3-5-6-7-19-12-14-21(15-13-19)17-16-20-10-8-18(4-2)9-11-20/h8-15H,3-7H2,1-2H3
InChIKey CFUOQVKZYPHWAN-UHFFFAOYSA-N
Mol Weight 276.42 g/mol
Molecular Formula C21H24
Exact Mass 276.187801 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ERvbUZmGHdF
Name 1-Ethyl-4-[(4-pentylphenyl)ethynyl]benzene
Alternate Name(s) 1-Amyl-4-[2-(4-ethylphenyl)ethynyl]benzene 1-Ethyl-4-[2-(4-pentylphenyl)ethynyl]benzene Benzene, 1-ethyl-4-[(4-pentylphenyl)ethynyl]-
CAS Registry Number 107949-20-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H24
InChI InChI=1S/C21H24/c1-3-5-6-7-19-12-14-21(15-13-19)17-16-20-10-8-18(4-2)9-11-20/h8-15H,3-7H2,1-2H3
InChIKey CFUOQVKZYPHWAN-UHFFFAOYSA-N
Molecular Weight 276.423 g/mol
SMILES CCc1ccc(cc1)C#Cc1ccc(cc1)CCCCC
SPLASH splash10-0gb9-0190000000-581ac9d71c44d21d8088
Source of Spectrum O-26-140-3
Wiley ID 1280707