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_210 synonyms

1-(4-acetoxyphenyl)-1-acetoxy ethane


Graphical representations:

lignin_cw_compound_210 image

Molecular Formula: C11 H14 O3

Natural Isotopic Abundance Mass: 194.22706

Mono-Isotopic Molecular Masses:

  • C12N14: 194.0942943157
  • C13N14: 205.1311975315
  • C12N15: 194.0942943157
  • C13N15: 205.1311975315

InCHi String:

Canonical and Isomeric SMILES: CC(C1=CC=C(C=C1)OC)OC(C)=O

1-(4-acetoxyphenyl)-1-acetoxy ethane

PubChem Substance (SID):   n/a
PubChem Compound (CID):   n/a
KEGG: Compound ID   n/a
CAS Registry IDs:   n/a
PDB Chemical Component   n/a
NMR Lignin Database 210
Miscellaneous Databases and IDs:   n/a

Reference data were obtained primarily from the PubChem database.

Three dimensional molecular rendering uses Jmol.