CHEBI:189160 - Dibutylone

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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 Dibutylone
ChEBI ID CHEBI:189160
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
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Formula C13H17NO3
Net Charge 0
Average Mass 235.283
Monoisotopic Mass 235.12084
InChI InChI=1S/C13H17NO3/c1-4-10(14(2)3)13(15)9-5-6-11-12(7-9)17-8-16-11/h5-7,10H,4,8H2,1-3H3
InChIKey USEBIPUIVPERGC-UHFFFAOYSA-N
SMILES O1C=2C=C(C(=O)C(N(C)C)CC)C=CC2OC1
Metabolite of Species Details
Arabidopsis thaliana (NCBI:txid3702) Found in leaf (BTO:0000713). See: MetaboLights Study
ChEBI Ontology
Outgoing Dibutylone (CHEBI:189160) is a butanone (CHEBI:22951)
IUPAC Name
1-(1,3-benzodioxol-5-yl)-2-(dimethylamino)butan-1-one
Manual Xref Database
52084597 ChemSpider
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Registry Number Type Source
802286-83-5 CAS Registry Number ChemIDplus