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Substance Name: Benzo(a)pyrene-7,8,9-triol, 7,8-dihydro-, trans-
RN: 68777-23-1
InChIKey: WAMAFMBEEYFMLZ-PMACEKPBSA-N

Molecular Formula

  • C20-H14-O3

Molecular Weight

  • 302.328
 
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Names and Synonyms

  • Benzo(a)pyrene-7,8,9-triol, 7,8-dihydro-, trans-

Registry Numbers

CAS Registry Number

  • 68777-23-1

System Generated Number

  • 0068777231

Structure Descriptors

InChI

1S/C20H14O3/c21-16-9-14-13-7-6-11-3-1-2-10-4-5-12(18(13)17(10)11)8-15(14)19(22)20(16)23/h1-9,19-23H/t19-,20-/m0/s1

InChIKey

WAMAFMBEEYFMLZ-PMACEKPBSA-N

Smiles

c12c(cc3ccc4cccc5ccc1c3c45)[C@@H]([C@H](C(=C2)O)O)O