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Tiaprofenic acid ME MS3_1
SpectraBase Compound ID KhWePD4musX
InChI InChI=1S/C13H11OS/c1-2-11-8-9-12(15-11)13(14)10-6-4-3-5-7-10/h2-9H,1H3/q+1
InChIKey ZLCCHIWZPRMPNQ-UHFFFAOYSA-N
Mol Weight 215.29 g/mol
Molecular Formula C13H11OS
Exact Mass 215.053061 g/mol

Mass Spectrum (LC)

Mass Spectrum (LC)

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SpectraBase Spectrum ID AalEvaThYAf
Name Tiaprofenic acid ME MS3_1
Comments F: ITMS + c ESI d w Full ms3 [email protected] [email protected]
Copyright Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved.
InChI InChI=1S/C13H11OS/c1-2-11-8-9-12(15-11)13(14)10-6-4-3-5-7-10/h2-9H,1H3/q+1
InChIKey ZLCCHIWZPRMPNQ-UHFFFAOYSA-N
Ion Polarity P
Ionization Type ESI
SMILES C=1(SC(=CC1)[CH+]C)C(=O)C=1C=CC=CC1
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