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Donepezil-M (O-demethyl-) MS3_2
SpectraBase Compound ID 6BhCRGzSAdZ
InChI InChI=1S/C15H16O2/c1-3-4-5-6-11-7-12-9-14(16)15(17-2)10-13(12)8-11/h5-6,8-10H,1,3-4,7H2,2H3/p+1/b6-5-
InChIKey GTTKGBLOIHSUNJ-WAYWQWQTSA-O
Mol Weight 229.3 g/mol
Molecular Formula C15H17O2
Exact Mass 229.122855 g/mol

Mass Spectrum (LC)

Mass Spectrum (LC)

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SpectraBase Spectrum ID HFzb2P9ON7Z
Name Donepezil-M (O-demethyl-) MS3_2
Comments T: ITMS + c ESI d w Full ms3 [email protected] [email protected] [50.00-240.00]
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InChI InChI=1S/C15H16O2/c1-3-4-5-6-11-7-12-9-14(16)15(17-2)10-13(12)8-11/h5-6,8-10H,1,3-4,7H2,2H3/p+1/b6-5-
InChIKey GTTKGBLOIHSUNJ-WAYWQWQTSA-O
Ion Polarity P
Ionization Type ESI
SMILES OC1=CC=2CC(\C=C/CC[CH2+])=CC2C=C1OC
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