Chem
J-GLOBAL ID：200907091674397939   Nikkaji number：J1.022.023H

6-Fluoro-7-methylbenzo[a]pyrene

6-フルオロ-7-メチルベンゾ[a]ピレン
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C21H13F
Molecular formula furigana： C21-H13-F
Molecular weight： 284.333
InChI： InChI=1S/C21H13F/c1-12-4-2-7-15-16-10-8-13-5-3-6-14-9-11-17(20(16)19(13)14)21(22)18(12)15/h2-11H,1H3
InChI key： LPMYQMMKGLDEEZ-UHFFFAOYSA-N
SMILES： Cc1cccc2c3ccc4cccc5ccc(c(F)c12)c3c45
Systematic name  (3)：
  • 6-フルオロ-7-メチルベンゾ[a]ピレン
  • 8-フルオロ-6-メチルペンタシクロ[10.6.2.02,7.09,19.016,20]イコサ-1(18),2,4,6,8,10,12,14,16,19-デカエン
  • 8-fluoro-6-methylpentacyclo[10.6.2.02,7.09,19.016,20]icosa-1(18),2,4,6,8,10,12,14,16,19-decaene
Other name (1)：
  • 6-Fluoro-7-methylbenzo[a]pyrene
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