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Niflumic acid
SpectraBase Compound ID 9bIgQI4nTHc
InChI InChI=1S/C13H9F3N2O2/c14-13(15,16)8-3-1-4-9(7-8)18-11-10(12(19)20)5-2-6-17-11/h1-7H,(H,17,18)(H,19,20)
InChIKey JZFPYUNJRRFVQU-UHFFFAOYSA-N
Mol Weight 282.22 g/mol
Molecular Formula C13H9F3N2O2
Exact Mass 282.061612 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Bp4rCz7LtNF
Name Niflumic acid
CAS Registry Number 4394-00-7
Classification Antirheumatic
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Exact Mass 282.061612025 u
Formula C13H9F3N2O2
InChI InChI=1S/C13H9F3N2O2/c14-13(15,16)8-3-1-4-9(7-8)18-11-10(12(19)20)5-2-6-17-11/h1-7H,(H,17,18)(H,19,20)
InChIKey JZFPYUNJRRFVQU-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 282.222 g/mol
SMILES c1cc(c(Nc2cc(ccc2)C(F)(F)F)nc1)C(O)=O
SPLASH splash10-0019-2290000000-488ee2da5cf1bddd82df
Sample Comments The MMPW Reference Handbook and associated Tables are attached to Record #1, under the Attachments tab. Refer to these references for an explanation of the Sample Preparation Procedure "Detected" abbreviations, as well as other relevant information pertaining to this database.
Source of Spectrum H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany
Technique GC/MS
Wiley ID MMPW6e_1404