CHEBI:186740 - Palmityl Trifluoromethyl Ketone

ChEBI IDCHEBI:186740
ChEBI NamePalmityl Trifluoromethyl Ketone
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC17H31F3O
Net Charge0
Average Mass308.428
Monoisotopic Mass308.23270
SMILESCCCCCCCCCCCCCCCC(=O)C(F)(F)F
InChIInChI=1S/C17H31F3O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16(21)17(18,19)20/h2-15H2,1H3
InChIKeyMAHYXYTYTLCTQD-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) feces (BTO:0000440) MetaboLights (MTBLS3750) Strain: C57BL/6 Mouse [NCIT:C14424]
ChEBI Ontology
Outgoing Relation(s)
Palmityl Trifluoromethyl Ketone (CHEBI:186740) is a α-haloketone (CHEBI:51839)
IUPAC Name 
1,1,1-triluoroheptadecan-2-one
Manual XrefsDatabases
4508ChemSpider