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1-[7-(trifluoromethyl)-3,4-dihydro-1H-isoquinolin-2-yl]ethanone
SpectraBase Compound ID EZLqy8S8ePa
InChI InChI=1S/C12H12F3NO/c1-8(17)16-5-4-9-2-3-11(12(13,14)15)6-10(9)7-16/h2-3,6H,4-5,7H2,1H3
InChIKey KPHDBLUELDEDJS-UHFFFAOYSA-N
Mol Weight 243.23 g/mol
Molecular Formula C12H12F3NO
Exact Mass 243.087098 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3sZJ1h4b7PR
Name 1-[7-(trifluoromethyl)-3,4-dihydro-1H-isoquinolin-2-yl]ethanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H12F3NO
InChI InChI=1S/C12H12F3NO/c1-8(17)16-5-4-9-2-3-11(12(13,14)15)6-10(9)7-16/h2-3,6H,4-5,7H2,1H3
InChIKey KPHDBLUELDEDJS-UHFFFAOYSA-N
Molecular Weight 243.229 g/mol
SMILES C1N(CCc2ccc(cc12)C(F)(F)F)C(=O)C
SPLASH splash10-0006-9550000000-1a741e1929817b47e694
Source of Spectrum F2-42-131-41
Wiley ID 1599974