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Tolbutamide-M (HO-alkyl) MS3_1
SpectraBase Compound ID 1sFKfwi27vz
InChI InChI=1S/C7H9NO2S/c1-6-2-4-7(5-3-6)11(8,9)10/h2-5H,1H3,(H2,8,9,10)/p+1
InChIKey LMYRWZFENFIFIT-UHFFFAOYSA-O
Mol Weight 172.22 g/mol
Molecular Formula C7H10NO2S
Exact Mass 172.043225 g/mol

Mass Spectrum (LC)

Mass Spectrum (LC)

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SpectraBase Spectrum ID GlxPkIw5OPl
Name Tolbutamide MS3_1
Comments T: ITMS + c ESI d w Full ms3 [email protected] [email protected]
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InChI InChI=1S/C7H9NO2S/c1-6-2-4-7(5-3-6)11(8,9)10/h2-5H,1H3,(H2,8,9,10)/p+1
InChIKey LMYRWZFENFIFIT-UHFFFAOYSA-O
Ion Polarity P
Ionization Type ESI
SMILES [NH3+]S(=O)(C1=CC=C(C=C1)C)=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 ms3
Technique ITMS