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Atomoxetine -H2O HYPFP        @
SpectraBase Compound ID 30d8MeJy2EL
InChI InChI=1S/C13H12F5NO/c1-19(11(20)12(14,15)13(16,17)18)9-5-8-10-6-3-2-4-7-10/h2-8H,9H2,1H3/b8-5-
InChIKey BQJIRVHMTUEUNY-YVMONPNESA-N
Mol Weight 293.24 g/mol
Molecular Formula C13H12F5NO
Exact Mass 293.083905 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KM0GWI1uM12
Name Atomoxetine -H2O HYPFP @
Classification Antidepressant
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Exact Mass 293.083904824 u
Formula C13H12F5NO
InChI InChI=1S/C13H12F5NO/c1-19(11(20)12(14,15)13(16,17)18)9-5-8-10-6-3-2-4-7-10/h2-8H,9H2,1H3/b8-5-
InChIKey BQJIRVHMTUEUNY-YVMONPNESA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 293.237 g/mol
SMILES C(C(N(C\C=C/c1ccccc1)C)=O)(F)(F)C(F)(F)F
SPLASH splash10-014i-3920000000-d558478923e8b902365a
Sample Comments The MMPW Reference Handbook and associated Tables are attached to Record #1, under the Attachments tab. Refer to these references for an explanation of the Sample Preparation Procedure "Detected" abbreviations, as well as other relevant information pertaining to this database.
Source of Spectrum H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany
Synonyms Fluoxetine -H2O HYPFP
Technique GC/MS
Wiley ID MMPW6e_7242