Dataset

mass spectrometry (MS)

dataset for mass spectrometry (MS)

Chemical Information

molecular Image
InChI InChI=1S/C8H8INO/c1-6(11)10-8-4-2-3-7(9)5-8/h2-5H,1H3,(H,10,11)
SMILES CC(=O)Nc1cccc(c1)I
InChI Key AMUUVYMMGLMBIW-UHFFFAOYSA-N
Molecular Formula C8H8INO
Exact Mass 261.060 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/AMUUVYMMGLMBIW-UHFFFAOYSA-N/Mass
License URL
Source https://www.chemotion-repository.net/inchikey/AMUUVYMMGLMBIW-UHFFFAOYSA-N/Mass
Version
Author Nicolai Wippert
Maintainer Chemotion Repository
Language english
MetadataPublished 2018-06-20
Related Molecule
  • N-(3-iodophenyl)acetamide
    • Field Value
    Measurement Technique mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    30487751 surechembl
    3709896 surechembl
    87971 pubchem
    A872BMD83C fdasrs
    XONLET CCDC
    Molport-000-395-977 molport
    The data in this table is sourced from UniChem at EBI.