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Azatadine
SpectraBase Compound ID 6U7nHOCSwIX
InChI InChI=1S/C20H22N2/c1-22-13-10-16(11-14-22)19-18-7-3-2-5-15(18)8-9-17-6-4-12-21-20(17)19/h2-7,12H,8-11,13-14H2,1H3
InChIKey SEBMTIQKRHYNIT-UHFFFAOYSA-N
Mol Weight 290.41 g/mol
Molecular Formula C20H22N2
Exact Mass 290.178299 g/mol

Mass Spectrum (LC)

Mass Spectrum (LC)

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SpectraBase Spectrum ID B8nAF2xE65J
Name Azatadine MS2
CAS Registry Number 3964-81-6
Comments F: ITMS + c ESI d w Full ms2 291.10
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Formula C20H22N2
InChI InChI=1S/C20H22N2/c1-22-13-10-16(11-14-22)19-18-7-3-2-5-15(18)8-9-17-6-4-12-21-20(17)19/h2-7,12H,8-11,13-14H2,1H3
InChIKey SEBMTIQKRHYNIT-UHFFFAOYSA-N
Ion Polarity P
Ionization Type ESI
SMILES C1(CCN(C)CC1)=C1C2=C(C=CC=N2)CCC2=CC=CC=C12
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: Parent
Source of Spectrum Maurer/Wissenbach/Weber, Saarland University
Spectrum Type ms2
Technique ITMS