Dataset

19F nuclear magnetic resonance spectroscopy (19F NMR)

dataset for 19F nuclear magnetic resonance spectroscopy (19F NMR)

Chemical Information

molecular Image
InChI InChI=1S/C8H7FO2/c1-5(10)7-3-2-6(9)4-8(7)11/h2-4,11H,1H3
SMILES Fc1ccc(c(c1)O)C(=O)C
InChI Key HLTBTUXAMVOKIH-UHFFFAOYSA-N
Exact Mass 154.138 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/HLTBTUXAMVOKIH-UHFFFAOYSA-N/CHMO0000597
License URL
Source https://www.chemotion-repository.net/inchikey/HLTBTUXAMVOKIH-UHFFFAOYSA-N/CHMO0000597
Version
Author Simone Gräßle
Maintainer Chemotion Repository
Language english
MetadataPublished 2025-07-21
Related Molecule
  • 1-(4-fluoro-2-hydroxyphenyl)ethanone
    • Field Value
    Measurement Technique 19F nuclear magnetic resonance spectroscopy
    Measurement Variables
    Data-Source Molecule ID Data-Source
    29797486 surechembl
    537488 surechembl
    2737326 pubchem
    MIXYAU CCDC
    Molport-000-155-582 molport
    The data in this table is sourced from UniChem at EBI.