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4'-HYDROXY-ATOMOXETINE-ACETATE;ISOLATED-METABOLITE
SpectraBase Compound ID 3YqohIyOPgJ
InChI InChI=1S/C17H21NO2.C2H4O2/c1-13-12-15(19)8-9-16(13)20-17(10-11-18-2)14-6-4-3-5-7-14;1-2(3)4/h3-9,12,17-19H,10-11H2,1-2H3;1H3,(H,3,4)/t17-;/m1./s1
InChIKey DLXVMFKHSNXZFI-UNTBIKODSA-N
Mol Weight 331.41 g/mol
Molecular Formula C19H25NO4
Exact Mass 331.178358 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID OXFNPT1x17
Name 4'-HYDROXY-ATOMOXETINE-ACETATE;ISOLATED-METABOLITE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H25NO4
InChI InChI=1S/C17H21NO2.C2H4O2/c1-13-12-15(19)8-9-16(13)20-17(10-11-18-2)14-6-4-3-5-7-14;1-2(3)4/h3-9,12,17-19H,10-11H2,1-2H3;1H3,(H,3,4)/t17-;/m1./s1
InChIKey DLXVMFKHSNXZFI-UNTBIKODSA-N
Literature Reference Author E.L.MATTIUZ,G.D.PONSLER,R.J.BARBUCH,P.G.WOOD,J.H.MULLEN,R.L. SHUGERT,Q.LI,W.J.WHE
Literature Reference Citation DRUG.MET.DISP.,31,88(2003)
Literature Reference DOI 10.1124/dmd.31.1.88
Molecular Weight 331.412 g/mol
Source File Reference UWLU74306