CHEBI:179718 - dodecyl octanoate

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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 dodecyl octanoate
ChEBI ID CHEBI:179718
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
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Formula C20H40O2
Net Charge 0
Average Mass 312.538
Monoisotopic Mass 312.30283
InChI InChI=1S/C20H40O2/c1-3-5-7-9-10-11-12-13-15-17-19-22-20(21)18-16-14-8-6-4-2/h3-19H2,1-2H3
InChIKey OYQTUTLMOLEYNR-UHFFFAOYSA-N
SMILES O(CCCCCCCCCCCC)C(=O)CCCCCCC
ChEBI Ontology
Outgoing dodecyl octanoate (CHEBI:179718) is a carboxylic ester (CHEBI:33308)
IUPAC Name
dodecyl octanoate
Manual Xrefs Databases
79823 ChemSpider
LMFA07010451 LIPID MAPS
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Registry Number Type Source
20292-09-5 CAS Registry Number ChemIDplus