N-(4-fluorophenyl)-2-pyrrolidin-1-ylacetamide

N-(4-fluorophenyl)-2-pyrrolidin-1-ylacetamide bmse011421 - Data

NMR Quality Control Of Fragment Libraries For Screening synonyms

Wikipedia:

Graphical representations:

NMR

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Molecular Formula: C12H15FN2O

Natural Isotopic Abundance Mass: 222.25870319999984

Mono-Isotopic Molecular Masses:

  • C12N14: 222.11684133
  • C13N14: 234.15709938600006
  • C12N15: 224.110911116
  • C13N15: 236.15116917200007

InChI string: InChI=1S/C12H15FN2O/c13-10-3-5-11(6-4-10)14-12(16)9-15-7-1-2-8-15/h3-6H,1-2,7-9H2,(H,14,16)

IUPAC: N-(4-fluorophenyl)-2-pyrrolidin-1-ylacetamide

wwPDB CCD: EJQ

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)