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Aprindine-M (N-deethyl-HO-ring) MS2
SpectraBase Compound ID 5Ys0llHg9lB
InChI InChI=1S/C20H26N2O/c1-2-21-12-5-13-22(18-8-10-20(23)11-9-18)19-14-16-6-3-4-7-17(16)15-19/h3-4,6-11,19,21,23H,2,5,12-15H2,1H3
InChIKey FPSVZFRKXFORRB-UHFFFAOYSA-N
Mol Weight 310.44 g/mol
Molecular Formula C20H26N2O
Exact Mass 310.204513 g/mol

Mass Spectrum (LC)

Mass Spectrum (LC)

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SpectraBase Spectrum ID Hp5MI1syq4t
Name Aprindine-M (N-deethyl-HO-ring) MS2
Comments F: ITMS + c ESI d w Full ms2 311.10
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Formula C20H26N2O
InChI InChI=1S/C20H26N2O/c1-2-21-12-5-13-22(18-8-10-20(23)11-9-18)19-14-16-6-3-4-7-17(16)15-19/h3-4,6-11,19,21,23H,2,5,12-15H2,1H3
InChIKey FPSVZFRKXFORRB-UHFFFAOYSA-N
Ion Polarity P
Ionization Type ESI
SMILES OC1=CC=C(N(CCCNCC)C2CC3=CC=CC=C3C2)C=C1
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 ms2
Technique ITMS