(2S)-1-(1,3-benzodioxol-5-ylmethylamino)propan-2-ol

(2S)-1-(1,3-benzodioxol-5-ylmethylamino)propan-2-ol bmse011300 - Data bmse012073 - Data

(2S)-1-(1,3-benzodioxol-5-ylmethylamino)propan-2-ol synonyms

Wikipedia:

Graphical representations:

(2S)-1-(1,3-benzodioxol-5-ylmethylamino)propan-2-ol

View large 3D structure

Molecular Formula: C11H15NO3

Natural Isotopic Abundance Mass: 209.24169999999998

Mono-Isotopic Molecular Masses:

  • C12N14: 209.105193345
  • C13N14: 220.14209656300005
  • C12N15: 210.102228238
  • C13N15: 221.13913145600006

InChI string: InChI=1S/C11H15NO3/c1-8(13)5-12-6-9-2-3-10-11(4-9)15-7-14-10/h2-4,8,12-13H,5-7H2,1H3/t8-/m0/s1

IUPAC: b'(2S)-1-(1,3-benzodioxol-5-ylmethylamino)propan-2-ol'

EU-OPENSCREEN: EOS102795

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)