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Diflunisal

View entire compound with spectra: 1 FTIR, 1 Raman, and 15 MS (GC)

Diflunisal
SpectraBase Compound ID 6BVIaDGz5z
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)
InChIKey HUPFGZXOMWLGNK-UHFFFAOYSA-N
Mol Weight 250.2 g/mol
Molecular Formula C13H8F2O3
Exact Mass 250.04415 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J7Sq0VAGASh
Name 2',4'-Difluoro-4-hydroxy-1,1'-biphenyl-3-carboxylic acid
Alternate Name(s) Diflunisal 2',4'-difluoro-4-hydroxy-[1,1'-biphenyl]-3-carboxylic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H8F2O3
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)
InChIKey HUPFGZXOMWLGNK-UHFFFAOYSA-N
Molecular Weight 250.201 g/mol
SMILES Oc1ccc(cc1C(O)=O)-c1ccc(cc1F)F
SPLASH splash10-053r-0190000000-f023b566ebf2d461adb9
Source of Spectrum CSC-11-SM15-3ey
Wiley ID 1812870