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Niflumic acid MS3_1
SpectraBase Compound ID GUSFCvjhNi7
InChI InChI=1S/C13H9FN2O2/c14-8-9-3-1-4-10(7-9)16-12-11(13(17)18)5-2-6-15-12/h1-8H,(H-,15,16,17,18)/p+1
InChIKey HLJUUWRUAIXCMD-UHFFFAOYSA-O
Mol Weight 245.23 g/mol
Molecular Formula C13H10FN2O2
Exact Mass 245.072631 g/mol

Mass Spectrum (LC)

Mass Spectrum (LC)

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SpectraBase Spectrum ID 9otgd5fHZQ
Name Niflumic acid MS3_1
Comments T: ITMS + c ESI d w Full ms3 [email protected] [email protected] [55.00-260.00]
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InChI InChI=1S/C13H9FN2O2/c14-8-9-3-1-4-10(7-9)16-12-11(13(17)18)5-2-6-15-12/h1-8H,(H-,15,16,17,18)/p+1
InChIKey HLJUUWRUAIXCMD-UHFFFAOYSA-O
Ion Polarity P
Ionization Type ESI
SMILES N(C1=CC=CC([CH+]F)=C1)C=1C(C(O)=O)=CC=CN1
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