CHEBI:141209 - (E)-hex-2-enyl acetate

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ChEBI Name (E)-hex-2-enyl acetate
ChEBI ID CHEBI:141209
ChEBI ASCII Name (E)-hex-2-enyl acetate
Definition An acetate ester resulting from the formal condensation of the hydroxy group of (E)-hex-2-en-1-ol with the carboxy group of acetic acid.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C8H14O2
Net Charge 0
Average Mass 142.196
Monoisotopic Mass 142.09938
InChI InChI=1S/C8H14O2/c1-3-4-5-6-7-10-8(2)9/h5-6H,3-4,7H2,1-2H3/b6-5+
InChIKey HRHOWZHRCRZVCU-AATRIKPKSA-N
SMILES C(C/C=C/COC(C)=O)C
Roles Classification
Biological Role(s): plant metabolite
Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
flavouring agent
A food additive that is used to added improve the taste or odour of a food.
Application(s): flavouring agent
A food additive that is used to added improve the taste or odour of a food.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing (E)-hex-2-enyl acetate (CHEBI:141209) has functional parent (E)-hex-2-en-1-ol (CHEBI:141205)
(E)-hex-2-enyl acetate (CHEBI:141209) has role flavouring agent (CHEBI:35617)
(E)-hex-2-enyl acetate (CHEBI:141209) has role plant metabolite (CHEBI:76924)
(E)-hex-2-enyl acetate (CHEBI:141209) is a acetate ester (CHEBI:47622)
(E)-hex-2-enyl acetate (CHEBI:141209) is a olefinic compound (CHEBI:78840)
IUPAC Name
(2E)-hex-2-en-1-yl acetate
Synonyms Sources
(E)-2-hexen-1-ol acetate NIST Chemistry WebBook
(E)-2-hexenyl acetate ChemIDplus
(E)-hex-2-enyl acetate NIST Chemistry WebBook
trans-2-hexen-1-yl acetate ChemIDplus
trans-2-hexenyl acetate ChemIDplus
trans-hex-2-en-1-yl acetate NIST Chemistry WebBook
trans-hex-2-enyl acetate NIST Chemistry WebBook
Manual Xrefs Databases
C00035766 KNApSAcK
FDB019924 FooDB
HMDB0040212 HMDB
LMFA07010178 LIPID MAPS
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Registry Numbers Types Sources
1721851 Reaxys Registry Number Reaxys
2497-18-9 CAS Registry Number ChemIDplus
2497-18-9 CAS Registry Number NIST Chemistry WebBook
Citations Waiting for Citations Types Sources
18408973 PubMed citation Europe PMC
20401755 PubMed citation Europe PMC
21535618 PubMed citation Europe PMC
23054031 PubMed citation Europe PMC
23678819 PubMed citation Europe PMC
23682312 PubMed citation Europe PMC
25172758 PubMed citation Europe PMC
28251439 PubMed citation Europe PMC
28682070 PubMed citation Europe PMC
IND44653025 Agricola citation Europe PMC
Last Modified
10 July 2018