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Substance Name: Benzo(a)pyrene-6-ethanol, acetate
RN: 105708-71-2
InChIKey: LYJIDCJAEAOXPH-UHFFFAOYSA-N

Molecular Formula

  • C24-H18-O2

Molecular Weight

  • 338.404
 
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Names and Synonyms

  • Benzo(a)pyrene-6-ethanol, acetate

Registry Numbers

CAS Registry Number

  • 105708-71-2

System Generated Number

  • 0105708712

Structure Descriptors

InChI

1S/C24H18O2/c1-15(25)26-14-13-20-18-7-2-3-8-19(18)21-11-9-16-5-4-6-17-10-12-22(20)24(21)23(16)17/h2-12H,13-14H2,1H3

InChIKey

LYJIDCJAEAOXPH-UHFFFAOYSA-N

Smiles

c12c(c(c3ccc4cccc5ccc1c3c45)CCOC(C)=O)cccc2