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Substance Name: Benzo(a)pyrene-7,8-diol, 7,8,9,10-tetrahydro-7-methyl-, cis-
RN: 94849-96-4
InChIKey: FMALTBPUQYDUQB-NQIIRXRSSA-N

Molecular Formula

  • C21-H18-O2

Molecular Weight

  • 302.371
 
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Names and Synonyms

Synonym

  • cis-7-Methyl-7,8,9,10-tetrahydrobenzo(a)pyrene-7,8-diol

Systematic Name

  • Benzo(a)pyrene-7,8-diol, 7,8,9,10-tetrahydro-7-methyl-, cis-

Registry Numbers

CAS Registry Number

  • 94849-96-4

System Generated Number

  • 0094849964

Structure Descriptors

InChI

1S/C21H18O2/c1-21(23)17-11-14-6-5-12-3-2-4-13-7-8-16(20(14)19(12)13)15(17)9-10-18(21)22/h2-8,11,18,22-23H,9-10H2,1H3/t18-,21+/m1/s1

InChIKey

FMALTBPUQYDUQB-NQIIRXRSSA-N

Smiles

c12c(cc3ccc4cccc5ccc1c3c45)[C@@]([C@@H](CC2)O)(O)C