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Trimipramine-D3 MS3_1
SpectraBase Compound ID 7GSv9a4CPnI
InChI InChI=1S/C18H20N/c1-14(2)13-19-17-9-5-3-7-15(17)11-12-16-8-4-6-10-18(16)19/h3-10,14H,1,11-13H2,2H3/q+1
InChIKey QHBJKTLSJPWZES-UHFFFAOYSA-N
Mol Weight 250.36 g/mol
Molecular Formula C18H20N
Exact Mass 250.159575 g/mol

Mass Spectrum (LC)

Mass Spectrum (LC)

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SpectraBase Spectrum ID AKl2QvrBtP7
Name Trimipramine-M/artifact (N-oxide dimer) MS3_2
Comments T: ITMS + c ESI d w Full ms3 [email protected] [email protected] [55.00-265.00]
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InChI InChI=1S/C18H20N/c1-14(2)13-19-17-9-5-3-7-15(17)11-12-16-8-4-6-10-18(16)19/h3-10,14H,1,11-13H2,2H3/q+1
InChIKey QHBJKTLSJPWZES-UHFFFAOYSA-N
Ion Polarity P
Ionization Type ESI
SMILES [CH2+]C(CN1C2=C(C=CC=C2)CCC2=C1C=CC=C2)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