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CHEBI:188652 - 2-(Trifluoroacetyl)-1,2,3,4-tetrahydroisoquinoline

ChEBI IDCHEBI:188652
ChEBI Name2-(Trifluoroacetyl)-1,2,3,4-tetrahydroisoquinoline
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC11H10F3NO
Net Charge0
Average Mass229.201
Monoisotopic Mass229.07145
SMILESO=C(N1CCc2ccccc2C1)C(F)(F)F
InChIInChI=1S/C11H10F3NO/c12-11(13,14)10(16)15-6-5-8-3-1-2-4-9(8)7-15/h1-4H,5-7H2
InChIKeyDVTYJMQWZHKOTG-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Phyllostachys violascens (ncbitaxon:1903417) stem (BTO:0001300) MetaboLights (MTBLS3970) Strain: Phyllostachys violascens cv. Viridisulcata
ChEBI Ontology
Outgoing Relation(s)
2-(Trifluoroacetyl)-1,2,3,4-tetrahydroisoquinoline (CHEBI:188652) is a isoquinolines (CHEBI:24922)
IUPAC Name 
1-(3,4-dihydro-1H-isoquinolin-2-yl)-2,2,2-triluoroethanone
Manual XrefsDatabases
534747ChemSpider