CHEBI:174156 - Octyl 2-furoate

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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 Octyl 2-furoate
ChEBI ID CHEBI:174156
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
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Formula C13H20O3
Net Charge 0
Average Mass 224.300
Monoisotopic Mass 224.14124
InChI InChI=1S/C13H20O3/c1-2-3-4-5-6-7-10-16-13(14)12-9-8-11-15-12/h8-9,11H,2-7,10H2,1H3
InChIKey WVTHGLPXSATJHZ-UHFFFAOYSA-N
SMILES O(CCCCCCCC)C(=O)C=1OC=CC1
ChEBI Ontology
Outgoing Octyl 2-furoate (CHEBI:174156) has functional parent 2-furoic acid (CHEBI:30845)
Octyl 2-furoate (CHEBI:174156) is a carboxylic ester (CHEBI:33308)
IUPAC Name
octyl uran-2-carboxylate
Manual Xrefs Databases
56626 ChemSpider
HMDB0037726 HMDB
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Registry Number Type Source
39251-88-2 CAS Registry Number ChemIDplus