CHEBI:173486 - Isopentenyl acetate

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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 Isopentenyl acetate
ChEBI ID CHEBI:173486
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
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Formula C7H12O2
Net Charge 0
Average Mass 128.171
Monoisotopic Mass 128.08373
InChI InChI=1S/C7H12O2/c1-6(2)4-5-9-7(3)8/h4H,5H2,1-3H3
InChIKey XXIKYCPRDXIMQM-UHFFFAOYSA-N
SMILES O(CC=C(C)C)C(=O)C
ChEBI Ontology
Outgoing Isopentenyl acetate (CHEBI:173486) is a carboxylic ester (CHEBI:33308)
IUPAC Name
3-methylbut-2-enyl acetate
Manual Xrefs Databases
13834 ChemSpider
HMDB0029314 HMDB
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Registry Number Type Source
1191-16-8 CAS Registry Number ChemIDplus