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Nicardipine MS3_1
SpectraBase Compound ID C2yDVEvzbyR
InChI InChI=1S/C16H14N2O5/c1-9-13(8-19)15(14(10(2)17-9)16(20)23-3)11-5-4-6-12(7-11)18(21)22/h4-7,15H,1-3H3/p+1
InChIKey YPIUFANKZLQORM-UHFFFAOYSA-O
Mol Weight 315.31 g/mol
Molecular Formula C16H15N2O5
Exact Mass 315.098097 g/mol

Mass Spectrum (LC)

Mass Spectrum (LC)

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SpectraBase Spectrum ID 9ZXXqbE0UsC
Name Lercanidipine-M/artifact (612) MS3_1
Comments F: ITMS + c ESI d w Full ms3 [email protected] [email protected]
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InChI InChI=1S/C16H14N2O5/c1-9-13(8-19)15(14(10(2)17-9)16(20)23-3)11-5-4-6-12(7-11)18(21)22/h4-7,15H,1-3H3/p+1
InChIKey YPIUFANKZLQORM-UHFFFAOYSA-O
Ion Polarity P
Ionization Type ESI
SMILES N1C(=C(C(C([C+]1C)=C=O)C1=CC(=CC=C1)N(=O)=O)C(=O)OC)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 ms3
Technique ITMS