BMRB

Biological Magnetic Resonance Data Bank


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

(1-ethylpyrrol-3-yl)methanamine

(1-ethylpyrrol-3-yl)methanamine bmse012384 - Data

(1-ethylpyrrol-3-yl)methanamine synonyms

Wikipedia:

Graphical representations:

(1-ethylpyrrol-3-yl)methanamine

View large 3D structure

Molecular Formula: C7H12N2

Natural Isotopic Abundance Mass: 124.18357999999998

Mono-Isotopic Molecular Masses:

  • C12N14: 124.100048394
  • C13N14: 131.12353226000002
  • C12N15: 126.09411818000001
  • C13N15: 133.11760204600003

InChI string: InChI=1S/C7H12N2/c1-2-9-4-3-7(5-8)6-9/h3-4,6H,2,5,8H2,1H3

EU-OPENSCREEN: EOS103134

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)