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Substance Name: Cholanthrene, 6-fluoro-3-methyl-
RN: 73771-73-0
InChIKey: PYGFTQSWNOAFAN-UHFFFAOYSA-N

Classification Code

  • Tumor Data

Molecular Formula

  • C21-H15-F

Molecular Weight

  • 286.3475
 
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Names and Synonyms

Synonyms

  • 6-Fluoro-3-methylcholanthrene
  • Benz(j)aceanthrylene, 1,2-dihydro-6-fluoro-3-methyl-

Systematic Name

  • Cholanthrene, 6-fluoro-3-methyl-

Registry Numbers

CAS Registry Number

  • 73771-73-0

System Generated Number

  • 0073771730

Structure Descriptors

InChI

1S/C21H15F/c1-12-6-8-18-19-14(12)10-11-16(19)17-9-7-13-4-2-3-5-15(13)20(17)21(18)22/h2-9H,10-11H2,1H3

InChIKey

PYGFTQSWNOAFAN-UHFFFAOYSA-N

Smiles

Cc1ccc2c3c1CCc3c4ccc5ccccc5c4c2F