Dataset

19F nuclear magnetic resonance spectroscopy (19F NMR)

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

Chemical Info

molecular Image
InChI InChI=1S/C14H19BF2O2/c1-4-5-11-12(16)6-10(7-13(11)17)15-18-8-14(2,3)9-19-15/h6-7H,4-5,8-9H2,1-3H3
SMILES CCCc1c(F)cc(cc1F)B1OCC(CO1)(C)C
InChI Key IVDPDZHHHSPIGG-UHFFFAOYSA-N
Molecular Formula C14H19BF2O2
Exact Mass 268.107 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/IVDPDZHHHSPIGG-UHFFFAOYSA-N/CHMO0000597
License URL
Source https://www.chemotion-repository.net/inchikey/IVDPDZHHHSPIGG-UHFFFAOYSA-N/CHMO0000597
Version
Author Peter Baeuerle
Maintainer Chemotion Repository
Language english
MetadataCreated 2025-01-29T10:50:23.904616
MetadataModified 2025-01-29T16:42:39.005638
MetadataPublished 2024-12-03
Related Molecule
  • 2-(3,5-difluoro-4-propylphenyl)-5,5-dimethyl-1,3,2-dioxaborinane
    • Field Value
    Measurement Technique 19F nuclear magnetic resonance spectroscopy
    Measurement Variables
    Data-Source Molecule ID Data-Source
    J1.908.701H Nikkaji
    16145798 PubChem: Thomson Pharma
    11076426 PubChem
    The data in this table is sourced from UniChem at EBI.