5-aminoisoindole-1,3-dione

5-aminoisoindole-1,3-dione bmse012001 - Data

5-aminoisoindole-1,3-dione synonyms

Wikipedia:

Graphical representations:

5-aminoisoindole-1,3-dione

View large 3D structure

Molecular Formula: C8H6N2O2

Natural Isotopic Abundance Mass: 162.14544

Mono-Isotopic Molecular Masses:

  • C12N14: 162.042927442
  • C13N14: 170.06976614600003
  • C12N15: 164.03699722800002
  • C13N15: 172.06383593200005

InChI string: InChI=1S/C8H6N2O2/c9-4-1-2-5-6(3-4)8(12)10-7(5)11/h1-3H,9H2,(H,10,11,12)

EU-OPENSCREEN: EOS102715

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)