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-(cyclopropylmethyl)azepane-1-sulfonamide

N-(cyclopropylmethyl)azepane-1-sulfonamide bmse012435 - Data

N-(cyclopropylmethyl)azepane-1-sulfonamide synonyms

Wikipedia:

Graphical representations:

N-(cyclopropylmethyl)azepane-1-sulfonamide

View large 3D structure

Molecular Formula: C10H20N2O2S

Natural Isotopic Abundance Mass: 232.34299999999996

Mono-Isotopic Molecular Masses:

  • C12N14: 232.12454889
  • C13N14: 242.15809727000004
  • C12N15: 234.118618676
  • C13N15: 244.15216705600005

InChI string: InChI=1S/C10H20N2O2S/c13-15(14,11-9-10-5-6-10)12-7-3-1-2-4-8-12/h10-11H,1-9H2

EU-OPENSCREEN: EOS103192

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)