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,N-dimethyl-1,2,3,4-tetrahydroquinoline-6-carboxamide

N,N-dimethyl-1,2,3,4-tetrahydroquinoline-6-carboxamide bmse012068 - Data

N,N-dimethyl-1,2,3,4-tetrahydroquinoline-6-carboxamide synonyms

Wikipedia:

Graphical representations:

N,N-dimethyl-1,2,3,4-tetrahydroquinoline-6-carboxamide

View large 3D structure

Molecular Formula: C12H16N2O

Natural Isotopic Abundance Mass: 204.26824

Mono-Isotopic Molecular Masses:

  • C12N14: 204.126263142
  • C13N14: 216.16652119800005
  • C12N15: 206.120332928
  • C13N15: 218.16059098400007

InChI string: InChI=1S/C12H16N2O/c1-14(2)12(15)10-5-6-11-9(8-10)4-3-7-13-11/h5-6,8,13H,3-4,7H2,1-2H3

EU-OPENSCREEN: EOS102790

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)