Lignin_cw_compound_154

Lignin_cw_compound_154 bmse010086 - Data

Lignin_cw_compound_154 synonyms

1-(4-hydroxy-3-methoxyphenyl)-2-(2-methoxyphenoxy)- ethanone

Wikipedia:

Graphical representations:

lignin_cw_compound_154

View large 3D structure

Molecular Formula: C16H16O5

Natural Isotopic Abundance Mass: 288.29524

Mono-Isotopic Molecular Masses:

  • C12N14: 288.0997736241
  • C13N14: 304.1534510289
  • C12N15: 288.0997736241
  • C13N15: 304.1534510289

InChI string: InChI=1/C16H16O5/c1-19-14-5-3-4-6-15(14)21-10-13(18)11-7-8-12(17)16(9-11)20-2/h3-9,17H,10H2,1-2H3

USDA_NMR_database: 154

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)