Lignin_cw_compound_291

Lignin_cw_compound_291 bmse010198 - Data

Lignin_cw_compound_291 synonyms

Unnamed

Wikipedia:

Graphical representations:

lignin_cw_compound_291

View large 3D structure

Molecular Formula: C11H14O4

Natural Isotopic Abundance Mass: 210.22646

Mono-Isotopic Molecular Masses:

  • C12N14: 210.0892089378
  • C13N14: 221.1261121536
  • C12N15: 210.0892089378
  • C13N15: 221.1261121536

InChI string: InChI=1S/C11H14O4/c1-7(12)11(13)8-4-5-9(14-2)10(6-8)15-3/h4-7,12H,1-3H3/t7-/m0/s1

USDA_NMR_database: 291

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)