Dataset

13C nuclear magnetic resonance spectroscopy (13C NMR)

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

Chemical Information

molecular Image
InChI InChI=1S/C12H11N4.ClH/c1-16-8-6-10(7-9-16)11-4-2-3-5-12(11)14-15-13;/h2-9H,1H3;1H/q+1;/p-1
SMILES [N-]=[N+]=Nc1ccccc1c1cc[n+](cc1)C.[Cl-]
InChI Key RFJCJXBPYRNNBV-UHFFFAOYSA-M
Molecular Formula C12H11ClN4
Exact Mass 246.696 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/RFJCJXBPYRNNBV-UHFFFAOYSA-M/CHMO0000595
License URL
Source https://www.chemotion-repository.net/inchikey/RFJCJXBPYRNNBV-UHFFFAOYSA-M/CHMO0000595
Version
Author Stefan Bräse
Maintainer Chemotion Repository
Language english
MetadataPublished 2023-03-10
Related Molecule
  • 4-(2-azidophenyl)-1-methylpyridin-1-ium;chloride
    • Field Value
    Measurement Technique 13C nuclear magnetic resonance spectroscopy
    Measurement Variables
    Data-Source Molecule ID Data-Source
    No additional information available for this Dataset.