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Substance Name: Benzo(a)pyrene, mixt. with iron oxide (Fe2-O3)
RN: 8076-07-1
InChIKey: JJIZPYYLPVNQSW-UHFFFAOYSA-N

Molecular Formula

  • C20-H12.Fe2-O3

Molecular Weight

  • 412.002
 
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Names and Synonyms

  • Benzo(a)pyrene, mixt. with iron oxide (Fe2-O3)

Registry Numbers

CAS Registry Number

  • 8076-07-1

System Generated Number

  • 0008076071

Molecular Formulas

Molecular Formula

  • C20-H12.Fe2-O3

Molecular Formula Fragments

  • C20-H12
  • COMPONENT
  • Fe2-O3

Structure Descriptors

InChI

1S/C20H12.2Fe.3O/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;;;;;/q;2*+3;3*-2

InChIKey

JJIZPYYLPVNQSW-UHFFFAOYSA-N

Smiles

[Fe+3].[Fe+3].[OH2-2].[OH2-2].[OH2-2].c12c(cc3ccc4cccc5ccc1c3c45)cccc2