2-fluoro-N-(1,3,4-thiadiazol-2-yl)benzamide

2-fluoro-N-(1,3,4-thiadiazol-2-yl)benzamide bmse011241 - Data bmse011817 - Data

NMR Quality Control Of Fragment Libraries For Screening synonyms

Wikipedia:

Graphical representations:

NMR

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Molecular Formula: C9H6FN3OS

Natural Isotopic Abundance Mass: 223.22684319999993

Mono-Isotopic Molecular Masses:

  • C12N14: 223.021561047
  • C13N14: 232.05175458900004
  • C12N15: 226.01266572600002
  • C13N15: 235.04285926800006

InChI string: InChI=1S/C9H6FN3OS/c10-7-4-2-1-3-6(7)8(14)12-9-13-11-5-15-9/h1-5H,(H,12,13,14)

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)