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3-(trifluoromethyl)-3,4-dihydro-2H-isoquinolin-1-one
SpectraBase Compound ID IsOtmFaguCz
InChI InChI=1S/C10H8F3NO/c11-10(12,13)8-5-6-3-1-2-4-7(6)9(15)14-8/h1-4,8H,5H2,(H,14,15)
InChIKey YEQNAFFJAWTAKQ-UHFFFAOYSA-N
Mol Weight 215.18 g/mol
Molecular Formula C10H8F3NO
Exact Mass 215.055798 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Dsb1i9CPS44
Name 3-(trifluoromethyl)-3,4-dihydro-2H-isoquinolin-1-one
Alternate Name(s) 3-(trifluoromethyl)-3,4-dihydroisocarbostyril
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H8F3NO
InChI InChI=1S/C10H8F3NO/c11-10(12,13)8-5-6-3-1-2-4-7(6)9(15)14-8/h1-4,8H,5H2,(H,14,15)
InChIKey YEQNAFFJAWTAKQ-UHFFFAOYSA-N
Molecular Weight 215.175 g/mol
SMILES N1C(Cc2c(C1=O)cccc2)C(F)(F)F
SPLASH splash10-00mk-3920000000-83d99cbc5b11299fddff
Source of Spectrum F2-42-3320-21
Wiley ID 1600314