Dataset

Tetrachlorosalicylanilide; LC-ESI-QFT; MS2; CE: 35 NCE; R=35000; [M-H]-

This MassBank record with Accession MSBNK-CASMI_2016-SM864051 contains the MS2 mass spectrum of Tetrachlorosalicylanilide with the InChIkey SJQBHPJLLIJASD-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C13H7Cl4NO2/c14-6-3-8(12(19)11(17)4-6)13(20)18-7-1-2-9(15)10(16)5-7/h1-5,19H,(H,18,20)
SMILES Oc1c(Cl)cc(Cl)cc1C(=O)Nc1ccc(Cl)c(Cl)c1
InChI Key SJQBHPJLLIJASD-UHFFFAOYSA-N
Molecular Formula C13H7Cl4NO2
Exact Mass 348.923 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-CASMI_2016-SM864051
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MetadataPublished 2016-12-12
Related Molecule
  • 3,5-dichloro-N-(3,4-dichlorophenyl)-2-hydroxybenzamide
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    CHEBI:188648 chebi
    CHEMBL291338 chembl
    168748 surechembl
    29367227 surechembl
    14385 pubchem
    PD052331 probes_and_drugs
    174742 brenda
    HNE676755I fdasrs
    HMDB0246012 hmdb
    Molport-003-700-942 molport
    50215974 bindingdb
    The data in this table is sourced from UniChem at EBI.