Biological Magnetic Resonance Data Bank

A Repository for Data from NMR Spectroscopy on Proteins, Peptides, Nucleic Acids, and other Biomolecules
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Lignin_cw_compound_154 synonyms

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


Graphical representations:


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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,