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1-(7-amino-3,4-dihydro-1H-isoquinolin-2-yl)-2,2,2-trifluoro-ethanone

View entire compound with spectra: 1 MS (GC)

1-(7-amino-3,4-dihydro-1H-isoquinolin-2-yl)-2,2,2-trifluoro-ethanone
SpectraBase Compound ID KDKqBC23Lfd
InChI InChI=1S/C11H11F3N2O/c12-11(13,14)10(17)16-4-3-7-1-2-9(15)5-8(7)6-16/h1-2,5H,3-4,6,15H2
InChIKey YEZPCNZZDHCZDL-UHFFFAOYSA-N
Mol Weight 244.22 g/mol
Molecular Formula C11H11F3N2O
Exact Mass 244.082347 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2sfL0lhG9w
Name 1-(7-amino-3,4-dihydro-1H-isoquinolin-2-yl)-2,2,2-trifluoro-ethanone
Alternate Name(s) 1-(7-azanyl-3,4-dihydro-1H-isoquinolin-2-yl)-2,2,2-tris(fluoranyl)ethanone 2-(trifluoroacetyl)-1,2,3,4-tetrahydro-7-isoquinolinamine
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Formula C11H11F3N2O
InChI InChI=1S/C11H11F3N2O/c12-11(13,14)10(17)16-4-3-7-1-2-9(15)5-8(7)6-16/h1-2,5H,3-4,6,15H2
InChIKey YEZPCNZZDHCZDL-UHFFFAOYSA-N
Molecular Weight 244.217 g/mol
SMILES Nc1ccc2CCN(Cc2c1)C(=O)C(F)(F)F
SPLASH splash10-014l-4980000000-a017671ff83476a077b2
Source of Spectrum F2-40-4001-13
Wiley ID 1599439