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Substance Name: 2-Benzo(a)pyren-6-ylcyclohexan-1-one
RN: 111189-41-4
InChIKey: WOZHVFABQMAQGE-UHFFFAOYSA-N

Molecular Formula

  • C26-H20-O

Molecular Weight

  • 348.443
 
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Names and Synonyms

  • 2-Benzo(a)pyren-6-ylcyclohexan-1-one

Registry Numbers

CAS Registry Number

  • 111189-41-4

System Generated Number

  • 0111189414

Structure Descriptors

InChI

1S/C26H20O/c27-23-11-4-3-10-21(23)25-19-9-2-1-8-18(19)20-14-12-16-6-5-7-17-13-15-22(25)26(20)24(16)17/h1-2,5-9,12-15,21H,3-4,10-11H2

InChIKey

WOZHVFABQMAQGE-UHFFFAOYSA-N

Smiles

C1([C@@H](CCCC1)c1c2c(c3ccc4cccc5ccc1c3c45)cccc2)=O