Dataset

2,6-Dichlorobenzamide; LC-ESI-ITFT; MS2; CE: 35; R=15000; [M+H]+

This MassBank record with Accession MSBNK-UFZ-UF405103 contains the MS2 mass spectrum of 2,6-Dichlorobenzamide with the InChIkey JHSPCUHPSIUQRB-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C7H5Cl2NO/c8-4-2-1-3-5(9)6(4)7(10)11/h1-3H,(H2,10,11)
SMILES NC(=O)C1=C(Cl)C=CC=C1Cl
InChI Key JHSPCUHPSIUQRB-UHFFFAOYSA-N
Molecular Formula C7H5Cl2NO
Exact Mass 188.975 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-UFZ-UF405103
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Maintainer
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MetadataPublished 2017-01-05
Related Molecule
  • 2,6-dichlorobenzamide
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    16183 PubChem
    16238858 PubChem: Thomson Pharma
    SCHEMBL320037 SureChEMBL
    2008-58-4 ACToR
    501406 eMolecules
    MTBLC28435 Metabolights
    CB5272558 ChemicalBook
    145225 Brenda
    198554 Brenda
    20039609 NMRShiftDB
    E9JWF529EB FDA SRS
    J29.504C Nikkaji
    ECUKUJ CCDC
    CHEMBL3184754 ChEMBL
    DTXSID7022170 EPA CompTox Dashboard
    MCULE-3690540095 Mcule
    ZINC000000156529 ZINC
    28435 ChEBI
    C10934 KEGG Ligand
    The data in this table is sourced from UniChem at EBI.