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Meclofenamic acid MS3_1
SpectraBase Compound ID JJSulXXBM7t
InChI InChI=1S/C14H10Cl2NO/c1-9-6-7-11(15)14(13(9)16)17-12-5-3-2-4-10(12)8-18/h2-7,17H,1H3/q+1
InChIKey MWGMQSFQWLREJF-UHFFFAOYSA-N
Mol Weight 279.15 g/mol
Molecular Formula C14H10Cl2NO
Exact Mass 278.013944 g/mol

Mass Spectrum (LC)

Mass Spectrum (LC)

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SpectraBase Spectrum ID 7VC4s0QXOy
Name Meclofenamic acid MS3_1
Comments T: ITMS + c ESI d w Full ms3 [email protected] [email protected] [65.00-290.00]
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InChI InChI=1S/C14H10Cl2NO/c1-9-6-7-11(15)14(13(9)16)17-12-5-3-2-4-10(12)8-18/h2-7,17H,1H3/q+1
InChIKey MWGMQSFQWLREJF-UHFFFAOYSA-N
Ion Polarity P
Ionization Type ESI
SMILES N(C1=C([C+]=O)C=CC=C1)C=1C(=C(C)C=CC1Cl)Cl
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