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Desloratadine-M (HO-alkyl) MS2
SpectraBase Compound ID 9wmj1SIENC7
InChI InChI=1S/C19H19ClN2O/c20-15-5-6-16-13(10-15)4-3-12-2-1-8-22-19(12)18(16)14-7-9-21-17(23)11-14/h1-2,5-6,8,10,17,21,23H,3-4,7,9,11H2/b18-14+
InChIKey VTCICERKTAILPP-NBVRZTHBSA-N
Mol Weight 326.83 g/mol
Molecular Formula C19H19ClN2O
Exact Mass 326.118591 g/mol

Mass Spectrum (LC)

Mass Spectrum (LC)

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SpectraBase Spectrum ID DtFzBiGoF6R
Name Loratadine-M (N-dealky-HO-alkyl) MS2
Comments F: ITMS + c ESI d w Full ms2 327.10
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Formula C19H19ClN2O
InChI InChI=1S/C19H19ClN2O/c20-15-5-6-16-13(10-15)4-3-12-2-1-8-22-19(12)18(16)14-7-9-21-17(23)11-14/h1-2,5-6,8,10,17,21,23H,3-4,7,9,11H2/b18-14+
InChIKey VTCICERKTAILPP-NBVRZTHBSA-N
Ion Polarity P
Ionization Type ESI
SMILES N1C(C\C(=C/2C3=C(C=C(C=C3)Cl)CCC3=C2N=CC=C3)CC1)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 ms2
Technique ITMS