Dataset

1H nuclear magnetic resonance spectroscopy (1H NMR)

dataset for 1H nuclear magnetic resonance spectroscopy (1H NMR)

Chemical Information

molecular Image
InChI InChI=1S/C15H26O3/c1-2-3-4-5-6-7-8-9-10-14-13(16)11-12-15(17)18-14/h11-12,14-15,17H,2-10H2,1H3/t14-,15?/m0/s1
SMILES CCCCCCCCCC[C@@H]1OC(O)C=CC1=O
InChI Key ZWUNUXNXAVPNGF-MLCCFXAWSA-N
Molecular Formula C15H26O3
Exact Mass 254.365 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/ZWUNUXNXAVPNGF-MLCCFXAWSA-N/CHMO0000593
License URL
Source https://www.chemotion-repository.net/inchikey/ZWUNUXNXAVPNGF-MLCCFXAWSA-N/CHMO0000593
Version
Author Toni Ditfe
Maintainer Chemotion Repository
Language english
MetadataPublished 2022-11-16
Related Molecule
  • (6S)-6-decyl-2-hydroxy-2H-pyran-5-one
    • Field Value
    Measurement Technique 1H nuclear magnetic resonance spectroscopy
    Measurement Variables
    Data-Source Molecule ID Data-Source
    14641217 pubchem
    The data in this table is sourced from UniChem at EBI.