Dataset

mass spectrometry (MS)

dataset for mass spectrometry (MS)

Chemical Information

molecular Image
InChI InChI=1S/C9H8INO/c1-2-9(12)11-8-5-3-7(10)4-6-8/h2-6H,1H2,(H,11,12)
SMILES C=CC(=O)Nc1ccc(cc1)I
InChI Key YOVKKEFXBXCYQV-UHFFFAOYSA-N
Molecular Formula C9H8INO
Exact Mass 273.070 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/YOVKKEFXBXCYQV-UHFFFAOYSA-N/Mass
License URL
Source https://www.chemotion-repository.net/inchikey/YOVKKEFXBXCYQV-UHFFFAOYSA-N/Mass
Version
Author Nicolai Wippert
Maintainer Chemotion Repository
Language english
MetadataPublished 2018-06-25
Related Molecule
  • N-(4-iodophenyl)prop-2-enamide
    • Field Value
    Measurement Technique mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    CHEMBL1171874 chembl
    19393388 surechembl
    43405538 pubchem
    The data in this table is sourced from UniChem at EBI.