Dataset

13C nuclear magnetic resonance spectroscopy (13C NMR)

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

Chemical Information

molecular Image
InChI InChI=1S/C10H12N2O2/c1-12(2)10(13)14-11-8-9-6-4-3-5-7-9/h3-8H,1-2H3/b11-8+
SMILES CN(C(=O)O/N=C/c1ccccc1)C
InChI Key JFDJXXRTHCTUME-DHZHZOJOSA-N
Exact Mass 192.214 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/JFDJXXRTHCTUME-DHZHZOJOSA-N/CHMO0000595
License URL
Source https://www.chemotion-repository.net/inchikey/JFDJXXRTHCTUME-DHZHZOJOSA-N/CHMO0000595
Version
Author Robert Göstl
Maintainer Chemotion Repository
Language english
MetadataPublished 2025-11-03
Related Molecule
  • nfdi4chem-mol3592 (Unknown Molecule)
    • Field Value
    Measurement Technique CHMO:0000595
    Measurement Variables
    Data-Source Molecule ID Data-Source
    J438.181E Nikkaji
    The data in this table is sourced from UniChem at EBI.