Dataset

13C nuclear magnetic resonance spectroscopy (13C NMR)

dataset for 13C nuclear magnetic resonance spectroscopy (13C NMR)

Chemical Information

molecular Image
InChI InChI=1S/C12H16O3/c13-9-10-5-1-2-6-11(10)15-12-7-3-4-8-14-12/h1-2,5-6,12-13H,3-4,7-9H2
SMILES OCc1ccccc1OC1CCCCO1
InChI Key DNOVOKIWUSLPST-UHFFFAOYSA-N
Molecular Formula C12H16O3
Exact Mass 208.254 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/DNOVOKIWUSLPST-UHFFFAOYSA-N/NMR/13C/CDCl3/100
License URL
Source https://www.chemotion-repository.net/inchikey/DNOVOKIWUSLPST-UHFFFAOYSA-N/NMR/13C/CDCl3/100
Version
Author Nicole Jung
Maintainer Chemotion Repository
Language english
MetadataPublished 2014-05-27
Related Molecule
  • [2-(oxan-2-yloxy)phenyl]methanol
    • Field Value
    Measurement Technique 13C nuclear magnetic resonance spectroscopy
    Measurement Variables
    Data-Source Molecule ID Data-Source
    10512555 pubchem
    The data in this table is sourced from UniChem at EBI.