EU-OPENSCREEN Compound 103300

EU-OPENSCREEN Compound 103300 bmse012522 - Data

EU-OPENSCREEN Compound 103300 synonyms

Wikipedia:

Graphical representations:

EU-OPENSCREEN

View large 3D structure

Molecular Formula: C9H14F2N2O

Natural Isotopic Abundance Mass: 204.21706639999996

Mono-Isotopic Molecular Masses:

  • C12N14: 204.107419518
  • C13N14: 213.13761306000004
  • C12N15: 206.101489304
  • C13N15: 215.13168284600005

InChI string: InChI=1S/C9H14F2N2O/c1-8-3-4-13(7(14)12-2)5-6(8)9(8,10)11/h6H,3-5H2,1-2H3,(H,12,14)/t6-,8+/m0/s1

EU-OPENSCREEN: EOS103300

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)