1-(3,4-Diethynylphenyl)ethanone

ChemSpider ID: 24193942
Molecular Formula: C₁₂H₈O
Average mass: 168.191299 Da
Monoisotopic mass: 168.05751 Da
Systematic name

1-(3,4-Diethynylphenyl)ethanone
SMILES and InChIs

SMILES:

CC(=O)c1ccc(c(c1)C#C)C#C Copied

Std. InChI:

InChI=1S/C12H8O/c1-4-10-6-7-12(9(3)13)8-11(10)5-2/h1-2,6-8H,3H3 Copied

Std. InChIKey:

WHVGPBZFFHISFZ-UHFFFAOYSA-N Copied
Cite this record
CSID:24193942, http://www.chemspider.com/Chemical-Structure.24193942.html (accessed 06:30, May 25, 2012) Copied

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Predicted data is generated using the ACD/Labs’ ACD/PhysChem Suite, for more information see their website.

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