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Propiverine-M (nor-HO-HOOC-) MS2
SpectraBase Compound ID JWQ7nJ2i3rV
InChI InChI=1S/C22H25NO5/c24-20(25)13-16-27-22(17-7-3-1-4-8-17,18-9-5-2-6-10-18)21(26)28-19-11-14-23-15-12-19/h1-10,19,23H,11-16H2,(H,24,25)
InChIKey MBFQYJFCSSUHTG-UHFFFAOYSA-N
Mol Weight 383.44 g/mol
Molecular Formula C22H25NO5
Exact Mass 383.173273 g/mol

Mass Spectrum (LC)

Mass Spectrum (LC)

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SpectraBase Spectrum ID C2fxtcaWOPr
Name Propiverine-M (nor-HO-HOOC-) MS2
Comments F: ITMS + c ESI d w Full ms2 384.10
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Formula C22H25NO5
InChI InChI=1S/C22H25NO5/c24-20(25)13-16-27-22(17-7-3-1-4-8-17,18-9-5-2-6-10-18)21(26)28-19-11-14-23-15-12-19/h1-10,19,23H,11-16H2,(H,24,25)
InChIKey MBFQYJFCSSUHTG-UHFFFAOYSA-N
Ion Polarity P
Ionization Type ESI
SMILES OC(CCOC(C(OC1CCNCC1)=O)(C=1C=CC=CC1)C1=CC=CC=C1)=O
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