BMRB

Biological Magnetic Resonance Data Bank


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

(1S)-N-methyl-1-phenyl-1-pyridin-2-ylmethanamine

(1S)-N-methyl-1-phenyl-1-pyridin-2-ylmethanamine bmse012595 - Data

(1S)-N-methyl-1-phenyl-1-pyridin-2-ylmethanamine synonyms

Wikipedia:

Graphical representations:

(1S)-N-methyl-1-phenyl-1-pyridin-2-ylmethanamine

View large 3D structure

Molecular Formula: C13H14N2

Natural Isotopic Abundance Mass: 198.26365999999996

Mono-Isotopic Molecular Masses:

  • C12N14: 198.115698458
  • C13N14: 211.15931135200006
  • C12N15: 200.109768244
  • C13N15: 213.15338113800007

InChI string: InChI=1S/C13H14N2/c1-14-13(11-7-3-2-4-8-11)12-9-5-6-10-15-12/h2-10,13-14H,1H3/t13-/m0/s1

EU-OPENSCREEN: EOS103409

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)