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1'-[4-(4-Fluorophenyl)-4-hydroxybutyl]-[1,4'-bipiperidine]-4'-carboxamide
SpectraBase Compound ID Gb4GYjSBfYq
InChI InChI=1S/C21H32FN3O2/c22-18-8-6-17(7-9-18)19(26)5-4-12-24-15-10-21(11-16-24,20(23)27)25-13-2-1-3-14-25/h6-9,19,26H,1-5,10-16H2,(H2,23,27)
InChIKey FKFWAMUREQWAEQ-UHFFFAOYSA-N
Mol Weight 377.5 g/mol
Molecular Formula C21H32FN3O2
Exact Mass 377.247855 g/mol

Mass Spectrum (LC)

Mass Spectrum (LC)

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SpectraBase Spectrum ID 6rElyi3nXi6
Name Pipamperone-M (dihydro-) MS2
Comments F: ITMS + c ESI d w Full ms2 378.10
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Formula C21H32FN3O2
InChI InChI=1S/C21H32FN3O2/c22-18-8-6-17(7-9-18)19(26)5-4-12-24-15-10-21(11-16-24,20(23)27)25-13-2-1-3-14-25/h6-9,19,26H,1-5,10-16H2,(H2,23,27)
InChIKey FKFWAMUREQWAEQ-UHFFFAOYSA-N
Ion Polarity P
Ionization Type ESI
SMILES NC(C1(CCN(CCCC(C=2C=CC(F)=CC2)O)CC1)N1CCCCC1)=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