Dataset

nuclear magnetic resonance spectroscopy (NMR)

dataset for nuclear magnetic resonance spectroscopy (NMR)

Chemical Information

molecular Image
InChI InChI=1S/C19H16O4/c1-23-16-11-15(12-7-9-14(20)10-8-12)18(21)19(22)17(16)13-5-3-2-4-6-13/h2-11,20-22H,1H3
SMILES COc1cc(c2ccc(cc2)O)c(c(c1c1ccccc1)O)O
InChI Key NJXLDQMVOFLMIX-UHFFFAOYSA-N
Molecular Formula C19H16O4
Exact Mass 308.328 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/NJXLDQMVOFLMIX-UHFFFAOYSA-N/CHMO0000591
License URL
Source https://www.chemotion-repository.net/inchikey/NJXLDQMVOFLMIX-UHFFFAOYSA-N/CHMO0000591
Version
Author Anja Schueffler
Maintainer Chemotion Repository
Language english
MetadataPublished 2025-04-03
Related Molecule
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    • Field Value
    Measurement Technique nuclear magnetic resonance spectroscopy
    Measurement Variables
    Data-Source Molecule ID Data-Source
    No additional information available for this Dataset.