BMRB

Biological Magnetic Resonance Data Bank


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

[(1R,3S)-1-amino-3-ethoxy-2,2-dimethylcyclobutyl]methanol

[(1R,3S)-1-amino-3-ethoxy-2,2-dimethylcyclobutyl]methanol bmse012221 - Data

[(1R,3S)-1-amino-3-ethoxy-2,2-dimethylcyclobutyl]methanol synonyms

Wikipedia:

Graphical representations:

[(1R,3S)-1-amino-3-ethoxy-2,2-dimethylcyclobutyl]methanol

View large 3D structure

Molecular Formula: C9H19NO2

Natural Isotopic Abundance Mass: 173.25266000000002

Mono-Isotopic Molecular Masses:

  • C12N14: 173.141578853
  • C13N14: 182.17177239500003
  • C12N15: 174.138613746
  • C13N15: 183.16880728800004

InChI string: InChI=1S/C9H19NO2/c1-4-12-7-5-9(10,6-11)8(7,2)3/h7,11H,4-6,10H2,1-3H3/t7-,9-/m0/s1

EU-OPENSCREEN: EOS102954

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)