(6,6-²H₂)-6H-Benzo[cd]pyrene

ChemSpider ID: 8665763
Molecular Formula: C₁₉H₁₀D₂
Average mass: 242.310898 Da
Monoisotopic mass: 242.106461 Da
Systematic name

(6,6-²H₂)-6H-Benzo[cd]pyrene
SMILES and InChIs

SMILES:

[2H]C5([2H])c2cccc1ccc4c(c12)c3c5cccc3cc4 Copied

Std. InChI:

InChI=1S/C19H12/c1-3-12-7-9-14-10-8-13-4-2-6-16-11-15(5-1)17(12)19(14)18(13)16/h1-10H,11H2/i11D2 Copied

Std. InChIKey:

CFXWAPSYPXUYCO-ZWGOZCLVSA-N Copied
Cite this record
CSID:8665763, http://www.chemspider.com/Chemical-Structure.8665763.html (accessed 04:20, May 21, 2013) 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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