Dataset

13C nuclear magnetic resonance spectroscopy (13C NMR)

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

Chemical Information

molecular Image
InChI InChI=1S/C13H10O2/c14-10-15-13-9-5-4-8-12(13)11-6-2-1-3-7-11/h1-10H
SMILES O=COc1ccccc1c1ccccc1
InChI Key HSLGAJRGTJJZAS-UHFFFAOYSA-N
Molecular Formula C13H10O2
Exact Mass 198.217 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/HSLGAJRGTJJZAS-UHFFFAOYSA-N/NMR/13C/CDCl3/62.5.1
License URL
Source https://www.chemotion-repository.net/inchikey/HSLGAJRGTJJZAS-UHFFFAOYSA-N/NMR/13C/CDCl3/62.5.1
Version
Author Simone Gräßle
Maintainer Chemotion Repository
Language english
MetadataPublished 2014-09-17
Related Molecule
  • (2-phenylphenyl) formate
    • Field Value
    Measurement Technique 13C nuclear magnetic resonance spectroscopy
    Measurement Variables
    Data-Source Molecule ID Data-Source
    2865511 surechembl
    21744772 pubchem
    The data in this table is sourced from UniChem at EBI.