Dataset

19F nuclear magnetic resonance spectroscopy (19F NMR)

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

Chemical Information

molecular Image
InChI InChI=1S/C8H7FO/c1-6-2-3-7(5-10)4-8(6)9/h2-5H,1H3
SMILES O=Cc1ccc(c(c1)F)C
InChI Key UFPBMVRONDLOGK-UHFFFAOYSA-N
Molecular Formula C8H7FO
Exact Mass 138.139 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/UFPBMVRONDLOGK-UHFFFAOYSA-N/CHMO0000597
License URL
Source https://www.chemotion-repository.net/inchikey/UFPBMVRONDLOGK-UHFFFAOYSA-N/CHMO0000597
Version
Author Simone Gräßle
Maintainer Chemotion Repository
Language english
MetadataPublished 2025-04-10
Related Molecule
  • 3-fluoro-4-methylbenzaldehyde
    • Field Value
    Measurement Technique 19F nuclear magnetic resonance spectroscopy
    Measurement Variables
    Data-Source Molecule ID Data-Source
    CHEMBL1650251 chembl
    229897 surechembl
    29453098 surechembl
    2774574 pubchem
    Molport-000-155-674 molport
    The data in this table is sourced from UniChem at EBI.