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CHEBI:195146 - 1-{[5-(Trifluoromethyl)-2-pyridyl]thio}acetone

ChEBI IDCHEBI:195146
ChEBI Name1-{[5-(Trifluoromethyl)-2-pyridyl]thio}acetone
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC9H8F3NOS
Net Charge0
Average Mass235.230
Monoisotopic Mass235.02787
SMILESCC(=O)CSc1ccc(C(F)(F)F)cn1
InChIInChI=1S/C9H8F3NOS/c1-6(14)5-15-8-3-2-7(4-13-8)9(10,11)12/h2-4H,5H2,1H3
InChIKeyWZOZPCJITYSPQU-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
1-{[5-(Trifluoromethyl)-2-pyridyl]thio}acetone (CHEBI:195146) is a aryl sulfide (CHEBI:35683)
IUPAC Name 
1-[5-(triluoromethyl)pyridin-2-yl]sulanylpropan-2-one