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Moexiprilate MS3_1
SpectraBase Compound ID 7cUw1ZTYVI5
InChI InChI=1S/C12H15NO4/c1-16-9-5-7-3-4-13-11(12(14)15)8(7)6-10(9)17-2/h5-6,11,13H,3-4H2,1-2H3,(H,14,15)/p+1
InChIKey OCPCZCANFUBIEX-UHFFFAOYSA-O
Mol Weight 238.26 g/mol
Molecular Formula C12H16NO4
Exact Mass 238.107933 g/mol

Mass Spectrum (LC)

Mass Spectrum (LC)

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SpectraBase Spectrum ID GUKdWoGjtqW
Name Moexipril-M (deethyl-) MS3_1
Comments T: ITMS + c ESI d w Full ms3 [email protected] [email protected] [50.00-250.00]
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InChI InChI=1S/C12H15NO4/c1-16-9-5-7-3-4-13-11(12(14)15)8(7)6-10(9)17-2/h5-6,11,13H,3-4H2,1-2H3,(H,14,15)/p+1
InChIKey OCPCZCANFUBIEX-UHFFFAOYSA-O
Ion Polarity P
Ionization Type ESI
SMILES [NH2+]1CCC2=C(C1C(=O)O)C=C(C(=C2)OC)OC
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 ms3
Technique ITMS