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Tiapride MS3_2
SpectraBase Compound ID 7wmW6EVnQLK
InChI InChI=1S/C9H9O4S/c1-13-9-4-3-8(14(2,11)12)5-7(9)6-10/h3-5H,1-2H3/q+1
InChIKey POZSRKJWHLWJLP-UHFFFAOYSA-N
Mol Weight 213.23 g/mol
Molecular Formula C9H9O4S
Exact Mass 213.022155 g/mol

Mass Spectrum (LC)

Mass Spectrum (LC)

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SpectraBase Spectrum ID 5UgKSnhQxM
Name Tiapride MS3_2
Comments T: ITMS + c ESI d w Full ms3 [email protected] [email protected] [50.00-225.00]
Copyright Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved.
InChI InChI=1S/C9H9O4S/c1-13-9-4-3-8(14(2,11)12)5-7(9)6-10/h3-5H,1-2H3/q+1
InChIKey POZSRKJWHLWJLP-UHFFFAOYSA-N
Ion Polarity P
Ionization Type ESI
SMILES [C+](C1=C(OC)C=CC(=C1)S(C)(=O)=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: Parent
Source of Spectrum Maurer/Wissenbach/Weber, Saarland University
Spectrum Type ms3
Technique ITMS