CHEBI:180436 - 2,4-Hexadienyl propionate

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name 2,4-Hexadienyl propionate
ChEBI ID CHEBI:180436
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
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Formula C9H14O2
Net Charge 0
Average Mass 154.209
Monoisotopic Mass 154.09938
InChI InChI=1S/C9H14O2/c1-3-5-6-7-8-11-9(10)4-2/h3,5-7H,4,8H2,1-2H3/b5-3+,7-6+
InChIKey ZVBREIRNEOXCKQ-TWTPFVCWSA-N
SMILES O(C/C=C/C=C/C)C(=O)CC
ChEBI Ontology
Outgoing 2,4-Hexadienyl propionate (CHEBI:180436) is a carboxylic ester (CHEBI:33308)
IUPAC Name
[(2E,4E)-hexa-2,4-dienyl] propanoate
Manual Xrefs Databases
4905427 ChemSpider
HMDB0032314 HMDB
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Registry Number Type Source
95994-92-6 CAS Registry Number ChemIDplus