Dataset

19F nuclear magnetic resonance spectroscopy (19F NMR)

Chemical Information

InChI	InChI=1S/C14H6F4O2/c15-9-1-7(2-10(16)5-9)13(19)14(20)8-3-11(17)6-12(18)4-8/h1-6H
SMILES	O=C(C(=O)c1cc(F)cc(c1)F)c1cc(F)cc(c1)F
InChI Key	ZDXXQKFXZDPNLI-UHFFFAOYSA-N
Exact Mass	282.190 g/mol

Data and Resources

• 19F nuclear magnetic resonance spectroscopy (19F NMR)HTML
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• 19f-nuclear-magneti...

Metadata Information

• Additional
• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.14272/ZDXXQKFXZDPNLI-UHFFFAOYSA-N/CHMO0000597
License URL
Source	https://www.chemotion-repository.net/inchikey/ZDXXQKFXZDPNLI-UHFFFAOYSA-N/CHMO0000597
Version
Author	Sarah Wulff
Maintainer	Chemotion Repository
Language	english
MetadataPublished	2026-02-03
Related Molecule

Field	Value
Measurement Technique	19F nuclear magnetic resonance spectroscopy
Measurement Variables

Data-Source Molecule ID	Data-Source
CHEMBL193229	chembl
2156965	surechembl
11437501	pubchem
PE9A4DX2VX	fdasrs
PD179152	probes_and_drugs
IWAXIQ	CCDC
10017	brenda
41035	bindingdb
41095	bindingdb
41155	bindingdb
41215	bindingdb
41275	bindingdb
50380482	bindingdb
50380487	bindingdb
50380586	bindingdb
50380588	bindingdb
51008005	bindingdb
51051509	bindingdb
51051525	bindingdb
The data in this table is sourced from UniChem at EBI.