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Donepezil MS3_2
SpectraBase Compound ID KhLm98imLBo
InChI InChI=1S/C16H19O2/c1-4-5-6-7-12-8-13-10-15(17-2)16(18-3)11-14(13)9-12/h6-8,10-11H,1,4-5,9H2,2-3H3/q+1/b7-6-
InChIKey NMBQOLWHPFJXJN-SREVYHEPSA-N
Mol Weight 243.33 g/mol
Molecular Formula C16H19O2
Exact Mass 243.138505 g/mol

Mass Spectrum (LC)

Mass Spectrum (LC)

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SpectraBase Spectrum ID 9pfY2vhgjbS
Name Donepezil-M (N-oxide) MS3_2
Comments T: ITMS + c ESI d w Full ms3 [email protected] [email protected] [55.00-255.00]
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InChI InChI=1S/C16H19O2/c1-4-5-6-7-12-8-13-10-15(17-2)16(18-3)11-14(13)9-12/h6-8,10-11H,1,4-5,9H2,2-3H3/q+1/b7-6-
InChIKey NMBQOLWHPFJXJN-SREVYHEPSA-N
Ion Polarity P
Ionization Type ESI
SMILES [CH2+]CC\C=C/C1=CC2=C(C1)C=C(C(=C2)OC)OC
Sample Comments The MWW Reference Handbook and associated table are attached to Record #1, under the Attachments tab. Refer to these references for the sample preparation procedure and abbreviations, as well as other relevant information pertaining to this database.
Sample Description Analyte Type: Metabolite
Source of Spectrum Maurer/Wissenbach/Weber, Saarland University
Spectrum Type ms3
Technique ITMS