Biological Magnetic Resonance Data Bank

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

Hydroxyphenylethanol Diacetate synonyms

Hydroxyphenylethanol diacetate; 1-acetoxy-1-(4-acetoxyphenyl)ethane


Graphical representations:

Hydroxyphenylethanol diacetate image

Molecular Formula: C12 H14 O4

Natural Isotopic Abundance Mass: 222.23716

Mono-Isotopic Molecular Masses:

  • C12N14: 222.0892089378
  • C13N14: 234.1294669914
  • C12N15: 222.0892089378
  • C13N15: 234.1294669914

InCHi String:

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

Hydroxyphenylethanol diacetate

PubChem Substance (SID):   111677919
PubChem Compound (CID):   n/a
KEGG: Compound ID   n/a
CAS Registry IDs:   n/a
PDB Chemical Component   n/a
NMR Lignin Database 23
Miscellaneous Databases and IDs:   n/a

Reference data were obtained primarily from the PubChem database.

Three dimensional molecular rendering uses Jmol.