1-[(4-fluorophenyl)methyl]benzimidazole

1-[(4-fluorophenyl)methyl]benzimidazole bmse011005 - Data

NMR Quality Control Of Fragment Libraries For Screening synonyms

Wikipedia:

Graphical representations:

NMR

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Molecular Formula: C14H11FN2

Natural Isotopic Abundance Mass: 226.24894319999984

Mono-Isotopic Molecular Masses:

  • C12N14: 226.090626582
  • C13N14: 240.13759431400007
  • C12N15: 228.084696368
  • C13N15: 242.13166410000008

InChI string: InChI=1S/C14H11FN2/c15-12-7-5-11(6-8-12)9-17-10-16-13-3-1-2-4-14(13)17/h1-8,10H,9H2

IUPAC: 1-[(4-fluorophenyl)methyl]benzimidazole

wwPDB CCD: GQP

Reference data were obtained primarily from the PubChem database.

Three dimensional molecular rendering uses Jmol.

InChI string and atom numbering calculated using ALATIS (Hesam Dashti, William M. Westler, John L. Markley, Hamid R. Eghbalnia, "Unique identifiers for small molecules enable rigorous labeling of their atoms", Scientific Data 4, Article number: 170073 (2017), doi:10.1038/sdata.2017.73, https://www.nature.com/articles/sdata201773)