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4-acetoxy-3,5-dimethoxy-trans-cinnamaldehyde

Go to external page http://purl.obolibrary.org/obo/CHEBI_86587

An acetate ester obtained by the formal condensation of hydroxy group of sinapoyl aldehyde with acetic acid.

Term info

Label

4-acetoxy-3,5-dimethoxy-trans-cinnamaldehyde

Synonyms
  • 2,6-dimethoxy-4-[(1E)-3-oxoprop-1-en-1-yl]phenyl acetate
database cross reference
Subsets

3_STAR

IUPAC NAME
2,6-dimethoxy-4-[(1E)-3-oxoprop-1-en-1-yl]phenyl acetate [ IUPAC ]

charge

0

formula

C13H14O5

has obo namespace

chebi_ontology

has related synonym

acetylated sinapaldehyde

id

CHEBI:86587

inchi

InChI=1S/C13H14O5/c1-9(15)18-13-11(16-2)7-10(5-4-6-14)8-12(13)17-3/h4-8H,1-3H3/b5-4+

inchikey

ZUJSHYQIANYKJH-SNAWJCMRSA-N

mass

250.24730

monoisotopicmass

250.08412

smiles

COc1cc(\C=C\C=O)cc(OC)c1OC(C)=O