CHEBI:180293 - 2-Methylallyl butyrate

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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-Methylallyl butyrate
ChEBI ID CHEBI:180293
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
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Formula C8H14O2
Net Charge 0
Average Mass 142.198
Monoisotopic Mass 142.09938
InChI InChI=1S/C8H14O2/c1-4-5-8(9)10-6-7(2)3/h2,4-6H2,1,3H3
InChIKey AHRIFIYGSJEEKU-UHFFFAOYSA-N
SMILES O(C(=O)CCC)CC(C)=C
ChEBI Ontology
Outgoing 2-Methylallyl butyrate (CHEBI:180293) is a fatty acid ester (CHEBI:35748)
IUPAC Name
2-methylprop-2-enyl butanoate
Manual Xrefs Databases
220358 ChemSpider
HMDB0036236 HMDB
LMFA07010722 LIPID MAPS
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Registry Number Type Source
7149-29-3 CAS Registry Number ChemIDplus