Dataset

13C nuclear magnetic resonance spectroscopy (13C NMR)

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

Chemical Information

molecular Image
InChI InChI=1S/C6H4N2O3/c9-7-5-1-3-6(4-2-5)8(10)11/h1-4H
SMILES O=Nc1ccc(cc1)[N+](=O)[O-]
InChI Key IDZTUECABAHWLE-UHFFFAOYSA-N
Molecular Formula C6H4N2O3
Exact Mass 152.108 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/IDZTUECABAHWLE-UHFFFAOYSA-N/13CNMR
License URL
Source https://www.chemotion-repository.net/inchikey/IDZTUECABAHWLE-UHFFFAOYSA-N/13CNMR
Version
Author Patrick Hodapp
Maintainer Chemotion Repository
Language english
MetadataPublished 2019-04-09
Related Molecule
  • 1-nitro-4-nitrosobenzene
    • Field Value
    Measurement Technique 13C nuclear magnetic resonance spectroscopy
    Measurement Variables
    Data-Source Molecule ID Data-Source
    4365351 surechembl
    643547 pubchem
    USAXOC CCDC
    The data in this table is sourced from UniChem at EBI.