N-(2-phenylethyl)-1H-benzimidazol-2-amine

N-(2-phenylethyl)-1H-benzimidazol-2-amine bmse011629 - Data

NMR Quality Control Of Fragment Libraries For Screening synonyms

Wikipedia:

Graphical representations:

NMR

View large 3D structure

Molecular Formula: C15H15N3

Natural Isotopic Abundance Mass: 237.2996999999998

Mono-Isotopic Molecular Masses:

  • C12N14: 237.126597495
  • C13N14: 252.17692006500008
  • C12N15: 240.11770217400002
  • C13N15: 255.1680247440001

InChI string: InChI=1S/C15H15N3/c1-2-6-12(7-3-1)10-11-16-15-17-13-8-4-5-9-14(13)18-15/h1-9H,10-11H2,(H2,16,17,18)

wwPDB CCD: LUY

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)