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Mirtazapine
SpectraBase Compound ID Iw7FbasOCOR
InChI InChI=1S/C17H19N3/c1-19-9-10-20-16(12-19)15-7-3-2-5-13(15)11-14-6-4-8-18-17(14)20/h2-8,16H,9-12H2,1H3
InChIKey RONZAEMNMFQXRA-UHFFFAOYSA-N
Mol Weight 265.36 g/mol
Molecular Formula C17H19N3
Exact Mass 265.157898 g/mol

Mass Spectrum (LC)

Mass Spectrum (LC)

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SpectraBase Spectrum ID j0U2DhhxBF
Name Mirtazapine-M (glycoside) MS3_1
Comments T: ITMS + c ESI d w Full ms3 [email protected] [email protected]
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Formula C17H19N3
InChI InChI=1S/C17H19N3/c1-19-9-10-20-16(12-19)15-7-3-2-5-13(15)11-14-6-4-8-18-17(14)20/h2-8,16H,9-12H2,1H3
InChIKey RONZAEMNMFQXRA-UHFFFAOYSA-N
Ion Polarity P
Ionization Type ESI
SMILES C=1C=C2C(C3N(C=4C(C2)=CC=CN4)CCN(C)C3)=CC1
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