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Loratadine MS3_2
SpectraBase Compound ID CkJ6KwZ4KXP
InChI InChI=1S/C19H17ClN/c1-3-13(4-2)18-17-10-9-16(20)12-15(17)8-7-14-6-5-11-21-19(14)18/h3,5-6,9-12H,1-2,4,7-8H2/q+1/b18-13-
InChIKey CCENSQCDHWSZJT-AQTBWJFISA-N
Mol Weight 294.81 g/mol
Molecular Formula C19H17ClN
Exact Mass 294.104952 g/mol

Mass Spectrum (LC)

Mass Spectrum (LC)

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SpectraBase Spectrum ID 2MimehKENPh
Name Loratadine MS3_2
Comments T: ITMS + c ESI d w Full ms3 [email protected] [email protected] [70.00-305.00]
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InChI InChI=1S/C19H17ClN/c1-3-13(4-2)18-17-10-9-16(20)12-15(17)8-7-14-6-5-11-21-19(14)18/h3,5-6,9-12H,1-2,4,7-8H2/q+1/b18-13-
InChIKey CCENSQCDHWSZJT-AQTBWJFISA-N
Ion Polarity P
Ionization Type ESI
SMILES C=C\C(=C/1C2=C(C=C(C=C2)Cl)CCC2=C1N=CC=C2)C[CH2+]
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 ms3
Technique ITMS