BMRB

Biological Magnetic Resonance Data Bank


A Repository for Data from NMR Spectroscopy on Proteins, Peptides, Nucleic Acids, and other Biomolecules 		Member of WWPDB

N-(5-amino-2-fluorophenyl)-2-phenylacetamide

N-(5-amino-2-fluorophenyl)-2-phenylacetamide bmse012332 - Data

N-(5-amino-2-fluorophenyl)-2-phenylacetamide synonyms

Wikipedia:

Graphical representations:

N-(5-amino-2-fluorophenyl)-2-phenylacetamide

View large 3D structure

Molecular Formula: C14H13FN2O

Natural Isotopic Abundance Mass: 244.26422319999992

Mono-Isotopic Molecular Masses:

  • C12N14: 244.101191266
  • C13N14: 258.14815899800004
  • C12N15: 246.095261052
  • C13N15: 260.14222878400005

InChI string: InChI=1S/C14H13FN2O/c15-12-7-6-11(16)9-13(12)17-14(18)8-10-4-2-1-3-5-10/h1-7,9H,8,16H2,(H,17,18)

EU-OPENSCREEN: EOS103078

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)