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CHEBI:184026 - Benzeneethanamine, 2,5-dimethoxy-4-(trifluoromethyl)-

ChEBI IDCHEBI:184026
ChEBI NameBenzeneethanamine, 2,5-dimethoxy-4-(trifluoromethyl)-
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC11H14F3NO2
Net Charge0
Average Mass249.232
Monoisotopic Mass249.09766
SMILESCOc1cc(C(F)(F)F)c(OC)cc1CCN
InChIInChI=1S/C11H14F3NO2/c1-16-9-6-8(11(12,13)14)10(17-2)5-7(9)3-4-15/h5-6H,3-4,15H2,1-2H3
InChIKeyLYXGNMLWYONZID-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Nippostrongylus brasiliensis (ncbitaxon:27835) Whole Organism (NCIT:C13413) MetaboLights (MTBLS3486)
Mus musculus (ncbitaxon:10090) small intestine (BTO:0000651) MetaboLights (MTBLS3486) Strain: C57BL/6 Mouse [THESAURUS.OWL#C14424]
ChEBI Ontology
Outgoing Relation(s)
Benzeneethanamine, 2,5-dimethoxy-4-(trifluoromethyl)- (CHEBI:184026) is a (trifluoromethyl)benzenes (CHEBI:83565)
IUPAC Name 
2-[2,5-dimethoxy-4-(triluoromethyl)phenyl]ethanamine
Manual XrefsDatabases
8575233ChemSpider