CHEBI:180222 - ethyl 3E-octenoate

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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 ethyl 3E-octenoate
ChEBI ID CHEBI:180222
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C10H18O2
Net Charge 0
Average Mass 170.252
Monoisotopic Mass 170.13068
InChI InChI=1S/C10H18O2/c1-3-5-6-7-8-9-10(11)12-4-2/h7-8H,3-6,9H2,1-2H3/b8-7+
InChIKey BCMYNNIPTQUKAC-BQYQJAHWSA-N
SMILES O(C(=O)C\C=C\CCCC)CC
ChEBI Ontology
Outgoing ethyl 3E-octenoate (CHEBI:180222) is a fatty acid ester (CHEBI:35748)
IUPAC Name
ethyl (E)-oct-3-enoate
Manual Xrefs Databases
4516553 ChemSpider
HMDB0032275 HMDB
LMFA07010522 LIPID MAPS
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Registry Number Type Source
26553-47-9 CAS Registry Number ChemIDplus