Dataset

13C nuclear magnetic resonance spectroscopy (13C NMR)

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

Chemical Information

molecular Image
InChI InChI=1S/C10H10/c1-3-9-5-7-10(4-2)8-6-9/h3-8H,1-2H2
SMILES C=Cc1ccc(cc1)C=C
InChI Key WEERVPDNCOGWJF-UHFFFAOYSA-N
Molecular Formula C10H10
Exact Mass 130.186 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/WEERVPDNCOGWJF-UHFFFAOYSA-N/NMR/13C/CDCl3/100
License URL
Source https://www.chemotion-repository.net/inchikey/WEERVPDNCOGWJF-UHFFFAOYSA-N/NMR/13C/CDCl3/100
Version
Author Mathias Lang
Maintainer Chemotion Repository
Language english
MetadataPublished 2014-05-27
Related Molecule
  • 1,4-bis(ethenyl)benzene
    • Field Value
    Measurement Technique 13C nuclear magnetic resonance spectroscopy
    Measurement Variables
    Data-Source Molecule ID Data-Source
    CHEMBL1520722 chembl
    11458762 surechembl
    7639 surechembl
    66041 pubchem
    QN8RGZ4ML2 fdasrs
    HEGQEP CCDC
    HMDB0256036 hmdb
    Molport-001-921-965 molport
    The data in this table is sourced from UniChem at EBI.