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Glibenclamide-M (HO-alkyl) MS3_1
SpectraBase Compound ID 3ec0AxetKwc
InChI InChI=1S/C16H17ClN2O5S/c1-24-15-7-4-11(17)8-13(15)16(21)19-9-14(20)10-2-5-12(6-3-10)25(18,22)23/h2-8,14,20H,9H2,1H3,(H,19,21)(H2,18,22,23)/p+1
InChIKey DWSYIQDIYGTHCL-UHFFFAOYSA-O
Mol Weight 385.84 g/mol
Molecular Formula C16H18ClN2O5S
Exact Mass 385.062496 g/mol

Mass Spectrum (LC)

Mass Spectrum (LC)

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SpectraBase Spectrum ID 5DvidbCZkGt
Name Glibenclamide-M (HO-alkyl) MS3_1
Comments T: ITMS + c ESI d w Full ms3 [email protected] [email protected] [95.00-400.00]
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InChI InChI=1S/C16H17ClN2O5S/c1-24-15-7-4-11(17)8-13(15)16(21)19-9-14(20)10-2-5-12(6-3-10)25(18,22)23/h2-8,14,20H,9H2,1H3,(H,19,21)(H2,18,22,23)/p+1
InChIKey DWSYIQDIYGTHCL-UHFFFAOYSA-O
Ion Polarity P
Ionization Type ESI
SMILES [NH3+]S(C1=CC=C(C(CNC(C2=C(C=CC(=C2)Cl)OC)=O)O)C=C1)(=O)=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: Metabolite
Source of Spectrum Maurer/Wissenbach/Weber, Saarland University
Spectrum Type ms3
Technique ITMS