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Flunixine MS2
SpectraBase Compound ID JBdXUZcqj0X
InChI InChI=1S/C14H11F3N2O2/c1-8-10(14(15,16)17)5-2-6-11(8)19-12-9(13(20)21)4-3-7-18-12/h2-7H,1H3,(H,18,19)(H,20,21)
InChIKey NOOCSNJCXJYGPE-UHFFFAOYSA-N
Mol Weight 296.25 g/mol
Molecular Formula C14H11F3N2O2
Exact Mass 296.077262 g/mol

Mass Spectrum (LC)

Mass Spectrum (LC)

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SpectraBase Spectrum ID 8K1lGfjbSy
Name Flunixine MS2
Comments F: ITMS + c ESI d w Full ms2 297.10
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Formula C14H11F3N2O2
InChI InChI=1S/C14H11F3N2O2/c1-8-10(14(15,16)17)5-2-6-11(8)19-12-9(13(20)21)4-3-7-18-12/h2-7H,1H3,(H,18,19)(H,20,21)
InChIKey NOOCSNJCXJYGPE-UHFFFAOYSA-N
Ion Polarity P
Ionization Type ESI
SMILES N(C1=C(C(=CC=C1)C(F)(F)F)C)C1=C(C(O)=O)C=CC=N1
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 ms2
Technique ITMS