Dataset

mass spectrometry (MS)

dataset for mass spectrometry (MS)

Chemical Information

molecular Image
InChI InChI=1S/C8H8BrNO/c1-6(11)10-8-5-3-2-4-7(8)9/h2-5H,1H3,(H,10,11)
SMILES CC(=O)Nc1ccccc1Br
InChI Key VOBKUOHHOWQHFZ-UHFFFAOYSA-N
Molecular Formula C8H8BrNO
Exact Mass 214.059 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/VOBKUOHHOWQHFZ-UHFFFAOYSA-N/Mass
License URL
Source https://www.chemotion-repository.net/inchikey/VOBKUOHHOWQHFZ-UHFFFAOYSA-N/Mass
Version
Author Nicolai Wippert
Maintainer Chemotion Repository
Language english
MetadataPublished 2018-06-20
Related Molecule
  • N-(2-bromophenyl)acetamide
    • Field Value
    Measurement Technique mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    29408737 surechembl
    422636 surechembl
    136416 pubchem
    MAVFAR CCDC
    Molport-001-768-738 molport
    The data in this table is sourced from UniChem at EBI.