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Alizapride-M (O-demethyl-) MS2
SpectraBase Compound ID EWXDe3Sl5l7
InChI InChI=1S/C15H19N5O2/c1-2-5-20-6-3-4-10(20)9-16-15(22)11-7-12-13(8-14(11)21)18-19-17-12/h2,7-8,10,21H,1,3-6,9H2,(H,16,22)(H,17,18,19)
InChIKey BSLSUCCQZXRXBT-UHFFFAOYSA-N
Mol Weight 301.35 g/mol
Molecular Formula C15H19N5O2
Exact Mass 301.153875 g/mol

Mass Spectrum (LC)

Mass Spectrum (LC)

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SpectraBase Spectrum ID 588rPaZRG6u
Name Alizapride-M (O-demethyl-) MS2
Comments F: ITMS + c ESI d w Full ms2 302.10
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Formula C15H19N5O2
InChI InChI=1S/C15H19N5O2/c1-2-5-20-6-3-4-10(20)9-16-15(22)11-7-12-13(8-14(11)21)18-19-17-12/h2,7-8,10,21H,1,3-6,9H2,(H,16,22)(H,17,18,19)
InChIKey BSLSUCCQZXRXBT-UHFFFAOYSA-N
Ion Polarity P
Ionization Type ESI
SMILES OC1=C(C(=O)NCC2CCCN2CC=C)C=C2C(=C1)N=NN2
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