BMRB

Biological Magnetic Resonance Data Bank


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

[(3R)-3-hydroxy-3-(trifluoromethyl)pyrrolidin-1-yl]-(5-methylfuran-2-yl)methanone

[(3R)-3-hydroxy-3-(trifluoromethyl)pyrrolidin-1-yl]-(5-methylfuran-2-yl)methanone synonyms

Wikipedia:

Graphical representations:

[(3R)-3-hydroxy-3-(trifluoromethyl)pyrrolidin-1-yl]-(5-methylfuran-2-yl)methanone

View large 3D structure

Molecular Formula: C11H12F3NO3

Natural Isotopic Abundance Mass: 263.21308959999993

Mono-Isotopic Molecular Masses:

  • C12N14: 263.076927909
  • C13N14: 274.113831127
  • C12N15: 264.073962802
  • C13N15: 275.11086602000006

InChI string: InChI=1S/C11H12F3NO3/c1-7-2-3-8(18-7)9(16)15-5-4-10(17,6-15)11(12,13)14/h2-3,17H,4-6H2,1H3/t10-/m1/s1

EU-OPENSCREEN: EOS103278

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)