3-(4-chlorophenyl)-5-ethyl-1,2,4-oxadiazole

3-(4-chlorophenyl)-5-ethyl-1,2,4-oxadiazole bmse011692 - Data

NMR Quality Control Of Fragment Libraries For Screening synonyms

Wikipedia:

Graphical representations:

NMR

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Molecular Formula: C10H9ClN2O

Natural Isotopic Abundance Mass: 208.64425999999992

Mono-Isotopic Molecular Masses:

  • C12N14: 208.040340598
  • C13N14: 218.07388897800004
  • C12N15: 210.034410384
  • C13N15: 220.06795876400005

InChI string: InChI=1S/C10H9ClN2O/c1-2-9-12-10(13-14-9)7-3-5-8(11)6-4-7/h3-6H,2H2,1H3

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)