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Azelastine
SpectraBase Compound ID 8JnjvHffEnb
InChI InChI=1S/C22H24ClN3O/c1-25-13-4-5-18(12-14-25)26-22(27)20-7-3-2-6-19(20)21(24-26)15-16-8-10-17(23)11-9-16/h2-3,6-11,18H,4-5,12-15H2,1H3
InChIKey MBUVEWMHONZEQD-UHFFFAOYSA-N
Mol Weight 381.91 g/mol
Molecular Formula C22H24ClN3O
Exact Mass 381.16079 g/mol

Mass Spectrum (LC)

Mass Spectrum (LC)

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SpectraBase Spectrum ID 7kuzFnafaKH
Name Azelastine MS2
CAS Registry Number 58581-89-8
Comments F: ITMS + c ESI d w Full ms2 382.10
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Formula C22H24ClN3O
InChI InChI=1S/C22H24ClN3O/c1-25-13-4-5-18(12-14-25)26-22(27)20-7-3-2-6-19(20)21(24-26)15-16-8-10-17(23)11-9-16/h2-3,6-11,18H,4-5,12-15H2,1H3
InChIKey MBUVEWMHONZEQD-UHFFFAOYSA-N
Ion Polarity P
Ionization Type ESI
SMILES C=1C=CC=2C(N(C3CCN(C)CCC3)N=C(CC3=CC=C(Cl)C=C3)C2C1)=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: Parent
Source of Spectrum Maurer/Wissenbach/Weber, Saarland University
Spectrum Type ms2
Technique ITMS