CHEBI:89215 - Ethyl isopropyl ketone

Main

ChEBI Ontology

Automatic Xrefs

Reactions

Pathways

Models

ChEBI Name Ethyl isopropyl ketone ChEBI ID CHEBI:89215 Stars This entity has been manually annotated by a third party. Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Wikipedia License Read full article at Wikipedia Formula C6H12O Net Charge 0 Average Mass 100.159 Monoisotopic Mass 100.08882 InChI InChI=1S/C6H12O/c1-4-6(7)5(2)3/h5H,4H2,1-3H3 InChIKey HYTRYEXINDDXJK-UHFFFAOYSA-N SMILES O=C(C(C)C)CC Metabolite of Species Details Homo sapiens (NCBI:txid9606) Found in faeces (UBERON:0001988). See: PubMed ChEBI Ontology Outgoing Ethyl isopropyl ketone (CHEBI:89215) is a ketone (CHEBI:17087) Synonyms Sources 2-Methyl-3-pentanal HMDB 2-Methyl-3-pentanone HMDB 2-Methylpentan-3-one HMDB 2-methylpentan-3-one HMDB 4-Methyl-3-pentanone HMDB Iso-C3H7COC2H5 HMDB Isopropyl ethyl ketone HMDB Manual Xrefs Databases 2-Methyl-3-pentanone Wikipedia HMDB0005846 HMDB View more database links Registry Number Type Source 565-69-5 CAS Registry Number KEGG COMPOUND Citations Types Sources 17314143 PubMed citation Europe PMC 5556886 PubMed citation Europe PMC