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Alimemazine-M (nor-HO-) MS2
SpectraBase Compound ID Bo97flYWpun
InChI InChI=1S/C17H20N2OS/c1-12(10-18-2)11-19-14-5-3-4-6-16(14)21-17-8-7-13(20)9-15(17)19/h3-9,12,18,20H,10-11H2,1-2H3
InChIKey MDYCLTQAUOIEOY-UHFFFAOYSA-N
Mol Weight 300.42 g/mol
Molecular Formula C17H20N2OS
Exact Mass 300.129634 g/mol

Mass Spectrum (LC)

Mass Spectrum (LC)

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SpectraBase Spectrum ID 8gnotHOLpPZ
Name Levomepromazine-M (nor-O-demethyl-glucuronide) MS3_1
Comments T: ITMS + c ESI d w Full ms3 [email protected] [email protected]
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Formula C17H20N2OS
InChI InChI=1S/C17H20N2OS/c1-12(10-18-2)11-19-14-5-3-4-6-16(14)21-17-8-7-13(20)9-15(17)19/h3-9,12,18,20H,10-11H2,1-2H3
InChIKey MDYCLTQAUOIEOY-UHFFFAOYSA-N
Ion Polarity P
Ionization Type ESI
SMILES N(CC(CN1C2=C(SC3=CC=C(C=C13)O)C=CC=C2)C)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