BMRB

Biological Magnetic Resonance Data Bank


A Repository for Data from NMR Spectroscopy on Proteins, Peptides, Nucleic Acids, and other Biomolecules
Member of WWPDB

4-acetoxy Cinnamaldehyde

4-acetoxy Cinnamaldehyde synonyms

4-acetoxy cinnamaldehyde; Coumaryl aldehyde acetate

Wikipedia:

Graphical representations:

4-acetoxy cinnamaldehyde image

Molecular Formula: C11 H10 O3

Natural Isotopic Abundance Mass: 190.1953

Mono-Isotopic Molecular Masses:

  • C12N14: 190.0629941873
  • C13N14: 201.0998974031
  • C12N15: 190.0629941873
  • C13N15: 201.0998974031

InCHi String:

Canonical and Isomeric SMILES: CC(=O)OC1=CC=C(C=CC=O)C=C1

Beilstein
4-acetoxy cinnamaldehyde

PubChem Substance (SID):   111678018
PubChem Compound (CID):   n/a
KEGG: Compound ID   n/a
CAS Registry IDs:   n/a
PDB Chemical Component   n/a
NMR Lignin Database 223
Miscellaneous Databases and IDs:   n/a

Reference data were obtained primarily from the PubChem database.

Three dimensional molecular rendering uses Jmol.