Dataset

mass spectrometry (MS)

dataset for mass spectrometry (MS)

Chemical Information

molecular Image
InChI InChI=1S/C8H5Cl3INO/c9-8(10,11)7(14)13-6-3-1-5(12)2-4-6/h1-4H,(H,13,14)
SMILES O=C(C(Cl)(Cl)Cl)Nc1ccc(cc1)I
InChI Key VIZCGGJGPNRJFW-UHFFFAOYSA-N
Molecular Formula C8H5Cl3INO
Exact Mass 364.395 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/VIZCGGJGPNRJFW-UHFFFAOYSA-N/Mass
License URL
Source https://www.chemotion-repository.net/inchikey/VIZCGGJGPNRJFW-UHFFFAOYSA-N/Mass
Version
Author Nicolai Wippert
Maintainer Chemotion Repository
Language english
MetadataPublished 2018-09-10
Related Molecule
  • 2,2,2-trichloro-N-(4-iodophenyl)acetamide
    • Field Value
    Measurement Technique mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    6933661 surechembl
    1797196 pubchem
    The data in this table is sourced from UniChem at EBI.