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Felodipine-M (dehydro-) MS3_1
SpectraBase Compound ID 3WmRHFt8ObU
InChI InChI=1S/C16H13Cl2NO4/c1-7-11(15(20)21)13(9-5-4-6-10(17)14(9)18)12(8(2)19-7)16(22)23-3/h4-6H,1-3H3,(H,20,21)/p+1
InChIKey DTAXOPSSIFVUSX-UHFFFAOYSA-O
Mol Weight 355.2 g/mol
Molecular Formula C16H14Cl2NO4
Exact Mass 354.029988 g/mol

Mass Spectrum (LC)

Mass Spectrum (LC)

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SpectraBase Spectrum ID 9UZGKHW9Jo
Name Felodipine-M (dehydro-) MS3_1
Comments T: ITMS + c ESI d w Full ms3 [email protected] [email protected] [85.00-365.00]
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InChI InChI=1S/C16H13Cl2NO4/c1-7-11(15(20)21)13(9-5-4-6-10(17)14(9)18)12(8(2)19-7)16(22)23-3/h4-6H,1-3H3,(H,20,21)/p+1
InChIKey DTAXOPSSIFVUSX-UHFFFAOYSA-O
Ion Polarity P
Ionization Type ESI
SMILES [OH2+]C(C=1C(=C(C(=NC1C)C)C(=O)OC)C1=C(C(Cl)=CC=C1)Cl)=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 ms3
Technique ITMS