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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 FsExvPy2S02
Name Diflunisal artifact (250)
Copyright Copyright © 2012-2024 John Wiley & Sons, Inc. Portions provided by AAFS, Toxicology Section. 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
SMILES Oc1ccc(cc1C(=O)O)-c1ccc(cc1F)F
SPLASH splash10-0fai-3890000000-16f5398eb1dabee61839
Source of Spectrum Mass Spectrometry Committee of the Toxicology Section of the American Academy of Forensic Sciences