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(3E)-2-Phenyl-3-phenylethynyl-1,3-octadiene
SpectraBase Compound ID HyNmRYEjJGj
InChI InChI=1S/C22H22/c1-3-4-7-14-22(18-17-20-12-8-5-9-13-20)19(2)21-15-10-6-11-16-21/h5-6,8-16H,2-4,7H2,1H3/b22-14+
InChIKey ZGIXMDGVXSPSLA-HYARGMPZSA-N
Mol Weight 286.42 g/mol
Molecular Formula C22H22
Exact Mass 286.172151 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID YrU6MPjhA
Name (3E)-2-Phenyl-3-phenylethynyl-1,3-octadiene
Alternate Name(s) (E)-(3-pentylidenepent-4-en-1-yne-1,4-diyl)dibenzene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H22
InChI InChI=1S/C22H22/c1-3-4-7-14-22(18-17-20-12-8-5-9-13-20)19(2)21-15-10-6-11-16-21/h5-6,8-16H,2-4,7H2,1H3/b22-14+
InChIKey ZGIXMDGVXSPSLA-HYARGMPZSA-N
Literature Reference DOI 10.1002/adsc.200800182
Molecular Weight 286.418 g/mol
SMILES C=C(\C(=C\CCCC)C#Cc1ccccc1)c1ccccc1
SPLASH splash10-0690-9630000000-330a6fb6c30c4ee08f2a
Source of Spectrum ASC-350-1841/SM10-E_10ba
Wiley ID 1765707