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4-Methyl-2,6-di-n-propyl-1,1'-(1,2-ethynediyl)bisbenzene
SpectraBase Compound ID CJa4uV3HheH
InChI InChI=1S/C21H24/c1-4-9-19-15-17(3)16-20(10-5-2)21(19)14-13-18-11-7-6-8-12-18/h6-8,11-12,15-16H,4-5,9-10H2,1-3H3
InChIKey AEEZVURQZHHXOR-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 B4OKimFqerw
Name 4-Methyl-2,6-di-n-propyl-1,1'-(1,2-ethynediyl)bisbenzene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H24
InChI InChI=1S/C21H24/c1-4-9-19-15-17(3)16-20(10-5-2)21(19)14-13-18-11-7-6-8-12-18/h6-8,11-12,15-16H,4-5,9-10H2,1-3H3
InChIKey AEEZVURQZHHXOR-UHFFFAOYSA-N
Molecular Weight 276.423 g/mol
SMILES C(#Cc1ccccc1)c1c(cc(cc1CCC)C)CCC
SPLASH splash10-0gdi-1190000000-41c7246e1c07ec50c0f3
Source of Spectrum AU-689-3746-10
Synonyms 5-Methyl-2-(phenylethynyl)-1,3-dipropylbenzene
Wiley ID 1576119