CHEBI:174070 - Tsibulin 1

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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 Tsibulin 1
ChEBI ID CHEBI:174070
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
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Formula C13H22O2
Net Charge 0
Average Mass 210.317
Monoisotopic Mass 210.16198
InChI InChI=1S/C13H22O2/c1-2-3-4-5-6-7-8-11-9-12(14)10-13(11)15/h11H,2-10H2,1H3
InChIKey SKPOJVSKGJMOJV-UHFFFAOYSA-N
SMILES O=C1C(CCCCCCCC)CC(=O)C1
ChEBI Ontology
Outgoing Tsibulin 1 (CHEBI:174070) is a β-diketone (CHEBI:67265)
IUPAC Name
4-octylcyclopentane-1,3-dione
Manual Xrefs Databases
157020 ChemSpider
HMDB0037390 HMDB
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Registry Number Type Source
126624-26-8 CAS Registry Number ChemIDplus