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Substance Name: (3-Acetyloxy-6-methoxybenzo(a)pyren-1-yl) acetate
RN: 74192-51-1
InChIKey: SVXPIRHIQCLSIY-UHFFFAOYSA-N

Molecular Formula

  • C25-H18-O5

Molecular Weight

  • 398.412
 
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Names and Synonyms

  • (3-Acetyloxy-6-methoxybenzo(a)pyren-1-yl) acetate

Registry Numbers

CAS Registry Number

  • 74192-51-1

System Generated Number

  • 0074192511

Structure Descriptors

InChI

1S/C25H18O5/c1-13(26)29-21-12-22(30-14(2)27)19-10-11-20-23-16(8-9-18(21)24(19)23)15-6-4-5-7-17(15)25(20)28-3/h4-12H,1-3H3

InChIKey

SVXPIRHIQCLSIY-UHFFFAOYSA-N

Smiles

c12c(c(c3ccc4c(cc(c5ccc1c3c45)OC(C)=O)OC(C)=O)OC)cccc2