Flunixin

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Systematic / IUPAC Name: 2-{[2-Methyl-3-(trifluoromethyl)phenyl]amino}nicotinic acid

ID: Reference1626

Other Names: 2-{[2-Methyl-3-(trifluoromethyl)phenyl]amino}-3-pyridinecarboxylic acid ;
3-Pyridinecarboxylic acid, 2-{[2-methyl-3-(trifluoromethyl)phenyl]amino}-

Formula: C14H11F3N2O2

Class: Therapeutics/Prescription Drugs

Spectral Data

Flunixin mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Q Exactive Orbitrap; Q Exactive Plus Orbitrap
No. of Spectral Trees 7
No. of Spectra 578
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 10/25/2016 1:53:47 PM
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Identificators

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)
InChI Key NOOCSNJCXJYGPE-UHFFFAOYSA-N
Canonical SMILES CC1=C(C=CC=C1NC2=C(C=CC=N2)C(=O)O)C(F)(F)F
CAS 38677859
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Other Names 2-{[2-Methyl-3-(trifluoromethyl)phenyl]amino}-3-pyridinecarboxylic acid ;
3-Pyridinecarboxylic acid, 2-{[2-methyl-3-(trifluoromethyl)phenyl]amino}-

In Other Databases

ChEBI CHEBI:76138
ChemSpider 34911
ChemIDPlus 038677859
KEGG D04215
ChEMBL CHEMBL1617398
Wikipedia Flunixin
PubChem 38081