Diflunisal

Systematic / IUPAC Name: 2',4'-Difluoro-4-hydroxy-3-biphenylcarboxylic acid

ID: Reference7262

Other Names: ν-Diflunisal;
Adomal;
Difludol;
Diflunisalum;
Diflusinal ; more

Formula: C13H8F2O3

Class: Therapeutics/Prescription Drugs

Spectral Data

Diflunisal 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
No. of Spectral Trees 1
No. of Spectra 69
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 1/16/2018 8:42:56 AM
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Identificators

InChI InChI=1S/C13H8F2O3/c14-8-2-3-9(11(15)6-8)7-1-4-12(16)10(5-7)13(17)18/h1-6,16H,(H,17,18)
InChI Key HUPFGZXOMWLGNK-UHFFFAOYSA-N
Canonical SMILES C1=CC(=C(C=C1C2=C(C=C(C=C2)F)F)C(=O)O)O
CAS 22494424
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Other Names ν-Diflunisal;
Adomal;
Difludol;
Diflunisalum;
Diflusinal;
Dolisal;
Dolobil;
Dolocid;
Flovacil;
Fluodonil;
Flustar;
(1,1'-Biphenyl)-3-carboxylic acid, 2',4'-difluoro-4-hydroxy-;
2-(Hydroxy)-5-(2,4-difluorophenyl)benzoic acid;
2',4'-Difluoro-4-hydroxy-(1,1'-biphenyl)-3-carboxylic acid;
2',4'-Difluoro-4-hydroxy-(1',1-diphenyl)-3-carboxylic acid;
2',4'-Difluoro-4-hydroxybiphenyl-3-carboxylic acid;
3-Biphenylcarboxylic acid, 2',4'-difluoro-4-hydroxy-;
5-(2,4-Difluorophenyl)-2-hydroxybenzoic acid;
5-(2,4-Difluorophenyl)salicylic acid

In Other Databases

HMDb HMDB14999
KEGG C01691; D00130
ChemIDPlus 022494424; 084145006
PubChem 3059
ChEBI CHEBI:39669
DrugBank DB00861
Wikipedia Diflunisal
ChEMBL CHEMBL898
ChemSpider 2951