Dataset

2,4,6-Triiodoaniline; LC-ESI-QTOF; MS2; 20 V

This MassBank record with Accession MSBNK-BAFG-CSL2311106580 contains the MS2 mass spectrum of 2,4,6-Triiodoaniline with the InChIkey GNOYQZRQXNVAKE-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C6H4I3N/c7-3-1-4(8)6(10)5(9)2-3/h1-2H,10H2
SMILES Nc1c(I)cc(I)cc1I
InChI Key GNOYQZRQXNVAKE-UHFFFAOYSA-N
Molecular Formula C6H4I3N
Exact Mass 470.748 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-BAFG-CSL2311106580
Version
Author
Maintainer
Language
MetadataPublished 2023-11-10
Related Molecule
  • 2,4,6-triiodoaniline
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    222556 PubChem
    MCULE-6406929807 Mcule
    ZINC000003885521 ZINC
    DTXSID20278663 EPA CompTox Dashboard
    J2.045.127K Nikkaji
    24154-37-8 ACToR
    2853960 eMolecules
    SCHEMBL612619 SureChEMBL
    The data in this table is sourced from UniChem at EBI.