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CHEBI:142921 - 3-phenylprop-2-enal

ChEBI IDCHEBI:142921
ChEBI Name3-phenylprop-2-enal
Stars
DefinitionA member of the class of cinnamaldehydes that is prop-2-enal in which a hydrogen at position 3 has been replaced by a phenyl group. The configuration of the double bond is not specified; the name "cinnamaldehyde" is widely used to refer to the E (trans) isomer.
Last Modified16 January 2019
SubmitterAnne Morgat
DownloadsMolfile
FormulaC9H8O
Net Charge0
Average Mass132.162
Monoisotopic Mass132.05751
SMILES[H]C(C=O)=C([H])c1ccccc1
InChIInChI=1S/C9H8O/c10-8-4-7-9-5-2-1-3-6-9/h1-8H
InChIKeyKJPRLNWUNMBNBZ-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
3-phenylprop-2-enal (CHEBI:142921) is a cinnamaldehydes (CHEBI:23245)
Incoming Relation(s)
(E)-cinnamaldehyde (CHEBI:16731) is a 3-phenylprop-2-enal (CHEBI:142921)
(Z)-3-phenyl-2-propenal (CHEBI:89729) is a 3-phenylprop-2-enal (CHEBI:142921)
Synonyms  Source
3-phenylpropenalSUBMITTER
3-phenylacrylaldehydeSUBMITTER
UniProt Name  Source
cinnamaldehydeUniProt
Registry NumbersSources
CAS:104-55-2PubChem Compound