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Mequitazine-M (sulfoxide)
SpectraBase Compound ID 9NNqfbCpG0J
InChI InChI=1S/C20H22N2OS/c23-24-19-7-3-1-5-17(19)22(18-6-2-4-8-20(18)24)14-16-13-21-11-9-15(16)10-12-21/h1-8,15-16H,9-14H2
InChIKey GWHIBUGIPBSCCU-UHFFFAOYSA-N
Mol Weight 338.47 g/mol
Molecular Formula C20H22N2OS
Exact Mass 338.145285 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KoVRaCVKYgI
Name Mequitazine-M (sulfoxide)
Classification Antihistamine
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Exact Mass 338.145284509 u
Formula C20H22N2OS
InChI InChI=1S/C20H22N2OS/c23-24-19-7-3-1-5-17(19)22(18-6-2-4-8-20(18)24)14-16-13-21-11-9-15(16)10-12-21/h1-8,15-16H,9-14H2
InChIKey GWHIBUGIPBSCCU-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 338.469 g/mol
SMILES c12ccccc2N(CC2CN3CCC2CC3)c2ccccc2S1=O
SPLASH splash10-00di-2911000000-3f8277267485f1977fac
Sample Comments The MMPW Reference Handbook and associated Tables are attached to Record #1, under the Attachments tab. Refer to these references for an explanation of the Sample Preparation Procedure "Detected" abbreviations, as well as other relevant information pertaining to this database.
Sample Preparation Procedure Detected: U UHY UHYAC
Source of Spectrum H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany
Technique GC/MS
Wiley ID MMPW6e_1670