Dataset

1H nuclear magnetic resonance spectroscopy (1H NMR)

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

Chemical Information

molecular Image
InChI InChI=1S/C9H10ClNO2/c10-5-9(13)11-8-4-2-1-3-7(8)6-12/h1-4,12H,5-6H2,(H,11,13)
SMILES ClCC(=O)Nc1ccccc1CO
InChI Key ZAEGYMSJKPJYAV-UHFFFAOYSA-N
Molecular Formula C9H10ClNO2
Exact Mass 199.634 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/ZAEGYMSJKPJYAV-UHFFFAOYSA-N/NMR/1H/CDCl3/400
License URL
Source https://www.chemotion-repository.net/inchikey/ZAEGYMSJKPJYAV-UHFFFAOYSA-N/NMR/1H/CDCl3/400
Version
Author Nicole Jung
Maintainer Chemotion Repository
Language english
MetadataPublished 2014-05-27
Related Molecule
  • 2-chloro-N-[2-(hydroxymethyl)phenyl]acetamide
    • Field Value
    Measurement Technique 1H nuclear magnetic resonance spectroscopy
    Measurement Variables
    Data-Source Molecule ID Data-Source
    2635445 surechembl
    22591220 pubchem
    Molport-008-750-207 molport
    The data in this table is sourced from UniChem at EBI.