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Moexiprilate MS2
SpectraBase Compound ID LPvlaQyqoHL
InChI InChI=1S/C25H30N2O7/c1-15(26-19(24(29)30)10-9-16-7-5-4-6-8-16)23(28)27-12-11-17-13-20(33-2)21(34-3)14-18(17)22(27)25(31)32/h4-8,13-15,19,22,26H,9-12H2,1-3H3,(H,29,30)(H,31,32)
InChIKey ZNMFIMQENYLVFI-UHFFFAOYSA-N
Mol Weight 470.52 g/mol
Molecular Formula C25H30N2O7
Exact Mass 470.205301 g/mol

Mass Spectrum (LC)

Mass Spectrum (LC)

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SpectraBase Spectrum ID 3tqrMuxWkeE
Name Moexipril-M (deethyl-)_neg
Collision Gas N2
Comments FTMS - p ESI d Full ms2 [email protected] [50.00-495.00]
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Formula C25H30N2O7
InChI InChI=1S/C25H30N2O7/c1-15(26-19(24(29)30)10-9-16-7-5-4-6-8-16)23(28)27-12-11-17-13-20(33-2)21(34-3)14-18(17)22(27)25(31)32/h4-8,13-15,19,22,26H,9-12H2,1-3H3,(H,29,30)(H,31,32)
InChIKey ZNMFIMQENYLVFI-UHFFFAOYSA-N
Inlet Type UHPLC
Instrument Name Thermo Fisher Q Exactive Orbitrap
Ion Polarity N
Ionization Type HESI
Precursor Ion [M-H]-
SMILES OC(C(CCC1=CC=CC=C1)NC(C(N1C(C(=O)O)C2=C(CC1)C=C(C(=C2)OC)OC)=O)C)=O
Sample Comments The MMHW Reference Handbook is attached to Record #1, under the Attachments tab. Refer to this reference for the sample preparation procedure and abbreviations, as well as other relevant information pertaining to this database.
Selected Ion Charge -1
Source of Spectrum Maurer/Meyer/Helfer/Weber c/o Saarland University Homburg/Saar
Spectrum Type ms2
Technique HCD