Dataset

5-Bromo-N-(4,5-dihydro-1H-imidazol-2-yl)-6-Quinoxalinamine; LC-ESI-QFT; MS2; CE: 45%; R=15000; [M+H]+

This MassBank record with Accession MSBNK-Eawag-EQ01078003 contains the MS2 mass spectrum of 5-Bromo-N-(4,5-dihydro-1H-imidazol-2-yl)-6-Quinoxalinamine with the InChIkey XYLJNLCSTIOKRM-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C11H10BrN5/c12-9-7(17-11-15-5-6-16-11)1-2-8-10(9)14-4-3-13-8/h1-4H,5-6H2,(H2,15,16,17)
SMILES C1CN=C(N1)NC2=C(C3=NC=CN=C3C=C2)Br
InChI Key XYLJNLCSTIOKRM-UHFFFAOYSA-N
Molecular Formula C11H10BrN5
Exact Mass 291.012 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by-sa/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Eawag-EQ01078003
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MetadataPublished 2024-06-14
Related Molecule
  • 5-bromo-N-(4,5-dihydro-1H-imidazol-2-yl)quinoxalin-6-amine
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    DB00484 drugbank
    CHEBI:3175 chebi
    J59 rcsb_pdb
    CHEMBL844 chembl
    24670 surechembl
    275296 surechembl
    29374525 surechembl
    2435 pubchem
    E6GNX3HHTE fdasrs
    J59 pdbe
    520 gtopdb
    5386 gtopdb
    PD000495 probes_and_drugs
    105613 brenda
    215760 brenda
    HMDB0014627 hmdb
    Molport-003-959-841 molport
    395 drugcentral
    34572 bindingdb
    The data in this table is sourced from UniChem at EBI.