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Trandolapril-M (deethyl-) MS2
SpectraBase Compound ID EpDYDMOeHnC
InChI InChI=1S/C22H30N2O5/c1-14(23-17(21(26)27)12-11-15-7-3-2-4-8-15)20(25)24-18-10-6-5-9-16(18)13-19(24)22(28)29/h2-4,7-8,14,16-19,23H,5-6,9-13H2,1H3,(H,26,27)(H,28,29)
InChIKey AHYHTSYNOHNUSH-UHFFFAOYSA-N
Mol Weight 402.49 g/mol
Molecular Formula C22H30N2O5
Exact Mass 402.215472 g/mol

Mass Spectrum (LC)

Mass Spectrum (LC)

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SpectraBase Spectrum ID 9fi1yTtkMuu
Name Trandolapril-M (deethyl-) MS2
Comments F: ITMS + c ESI d w Full ms2 403.10
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Formula C22H30N2O5
InChI InChI=1S/C22H30N2O5/c1-14(23-17(21(26)27)12-11-15-7-3-2-4-8-15)20(25)24-18-10-6-5-9-16(18)13-19(24)22(28)29/h2-4,7-8,14,16-19,23H,5-6,9-13H2,1H3,(H,26,27)(H,28,29)
InChIKey AHYHTSYNOHNUSH-UHFFFAOYSA-N
Ion Polarity P
Ionization Type ESI
SMILES N(C(C(=O)O)CCC=1C=CC=CC1)C(C(N1C(C(=O)O)CC2C1CCCC2)=O)C
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