BMRB

Biological Magnetic Resonance Data Bank


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

4-(2-fluorophenyl)-1,3-thiazol-2-amine

4-(2-fluorophenyl)-1,3-thiazol-2-amine bmse012238 - Data

4-(2-fluorophenyl)-1,3-thiazol-2-amine synonyms

Wikipedia:

Graphical representations:

4-(2-fluorophenyl)-1,3-thiazol-2-amine

View large 3D structure

Molecular Formula: C9H7FN2S

Natural Isotopic Abundance Mass: 194.2286832

Mono-Isotopic Molecular Masses:

  • C12N14: 194.031397454
  • C13N14: 203.06159099600004
  • C12N15: 196.02546724
  • C13N15: 205.05566078200005

InChI string: InChI=1S/C9H7FN2S/c10-7-4-2-1-3-6(7)8-5-13-9(11)12-8/h1-5H,(H2,11,12)

EU-OPENSCREEN: EOS102976

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)