Dataset

1H nuclear magnetic resonance spectroscopy (1H NMR)

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

Chemical Information

molecular Image
InChI InChI=1S/C12H10N2O3/c15-12(9-5-7-13-8-6-9)10-3-1-2-4-11(10)14(16)17/h1-8,12,15H
SMILES OC(c1ccccc1[N+](=O)[O-])c1ccncc1
InChI Key SZPZAHVJIQVVHN-UHFFFAOYSA-N
Molecular Formula C12H10N2O3
Exact Mass 230.219 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/SZPZAHVJIQVVHN-UHFFFAOYSA-N/CHMO0000593
License URL
Source https://www.chemotion-repository.net/inchikey/SZPZAHVJIQVVHN-UHFFFAOYSA-N/CHMO0000593
Version
Author Sylvia Vanderheiden-Schroen
Maintainer Chemotion Repository
Language english
MetadataPublished 2020-04-30
Related Molecule
  • (2-nitrophenyl)-pyridin-4-ylmethanol
    • Field Value
    Measurement Technique 1H nuclear magnetic resonance spectroscopy
    Measurement Variables
    Data-Source Molecule ID Data-Source
    23458474 surechembl
    12725125 pubchem
    The data in this table is sourced from UniChem at EBI.