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Benzo[a]pyrene-d12

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For Research Use Only | Not For Clinical Use
CATAPS63466717A
CAS63466-71-7
Structure
Synonyms[12-2H]Benzo[a]pyrene, Benzo[a]pyrene-d12 (9CI), Benzo[a]pyrene d12, Perdeuterated benzo[a]pyrene,Benzo[a]pyrene-1,2,3,4,5,6,7,8,9,10,11,12-d12, Benzo[a]pyrene D12
IUPAC Name1,2,3,4,5,6,7,8,9,10,11,12-dodecadeuteriobenzo[a]pyrene
Molecular Weight264.38
Molecular FormulaC202H12
Canonical SMILES[2H]c1c([2H])c([2H])c2c(c1[2H])c([2H])c3c([2H])c([2H])c4c([2H])c([2H])c([2H])c5c([2H])c([2H])c2c3c45
InChIInChI=1S/C20H12/c1-2-7-17-15(4-1)12-16-9-8-13-5-3-6-14-10-11-18(17)20(16)19(13)14/h1-12H/i1D,2D,3D,4D,5D,6D,7D,8D,9D,10D,11D,12D
Accurate Mass264.1692
FormatNeat
SubcategoryMycotoxins, Phenol and aromatic compounds, Polycyclic aromatic hydrocarbons (PAHs), Stable isotope labelled compounds
TypeStable Isotope Labelled
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