BMRB

Biological Magnetic Resonance Data Bank


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

(2R)-2-(2-chlorophenyl)pyrrolidine

(2R)-2-(2-chlorophenyl)pyrrolidine bmse012122 - Data

(2R)-2-(2-chlorophenyl)pyrrolidine synonyms

Wikipedia:

Graphical representations:

(2R)-2-(2-chlorophenyl)pyrrolidine

View large 3D structure

Molecular Formula: C10H12ClN

Natural Isotopic Abundance Mass: 181.66197999999997

Mono-Isotopic Molecular Masses:

  • C12N14: 181.065827069
  • C13N14: 191.09937544900004
  • C12N15: 182.062861962
  • C13N15: 192.09641034200004

InChI string: InChI=1S/C10H12ClN/c11-9-5-2-1-4-8(9)10-6-3-7-12-10/h1-2,4-5,10,12H,3,6-7H2/t10-/m1/s1

IUPAC: b'(2R)-2-(2-chlorophenyl)pyrrolidine'

EU-OPENSCREEN: EOS102848

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)