Dataset

13C nuclear magnetic resonance spectroscopy (13C NMR)

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

Chemical Information

molecular Image
InChI InChI=1S/C10H12ClNO/c1-7(2)12-10(13)8-3-5-9(11)6-4-8/h3-7H,1-2H3,(H,12,13)
SMILES CC(NC(=O)c1ccc(cc1)Cl)C
InChI Key MWWJUXGMIOUFOP-UHFFFAOYSA-N
Molecular Formula C10H12ClNO
Exact Mass 197.661 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/MWWJUXGMIOUFOP-UHFFFAOYSA-N/NMR/13C/CDCl3/62.5.1
License URL
Source https://www.chemotion-repository.net/inchikey/MWWJUXGMIOUFOP-UHFFFAOYSA-N/NMR/13C/CDCl3/62.5.1
Version
Author Daniele Antermite
Maintainer Chemotion Repository
Language english
MetadataPublished 2014-08-11
Related Molecule
  • 4-chloro-N-propan-2-ylbenzamide
    • Field Value
    Measurement Technique 13C nuclear magnetic resonance spectroscopy
    Measurement Variables
    Data-Source Molecule ID Data-Source
    8185351 surechembl
    24045 pubchem
    A8TTQ5Q7EA fdasrs
    Molport-000-419-774 molport
    The data in this table is sourced from UniChem at EBI.