Dataset

Robenidine; LC-ESI-QTOF; MS2; CE: 50 eV; R=35000; [M+H]+

This MassBank record with Accession MSBNK-Athens_Univ-AU109305 contains the MS2 mass spectrum of Robenidine with the InChIkey MOOFYEJFXBSZGE-LQGKIZFRSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C15H13Cl2N5/c16-13-5-1-11(2-6-13)9-19-21-15(18)22-20-10-12-3-7-14(17)8-4-12/h1-10H,(H3,18,21,22)/b19-9+,20-10+
SMILES C1=CC(=CC=C1/C=N/NC(=N)N/N=C/C2=CC=C(C=C2)Cl)Cl
InChI Key MOOFYEJFXBSZGE-LQGKIZFRSA-N
Molecular Formula C15H13Cl2N5
Exact Mass 333.055 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-Athens_Univ-AU109305
Version
Author
Maintainer
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MetadataPublished 2015-09-22
Related Molecule
  • 1,2-bis[(E)-(4-chlorophenyl)methylideneamino]guanidine
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    DB11542 drugbank
    CHEBI:228790 chebi
    CHEMBL97137 chembl
    17536045 surechembl
    28694173 surechembl
    571509 surechembl
    21419483 pubchem
    51854790 pubchem
    9570438 pubchem
    4888ME6C4E fdasrs
    PD013564 probes_and_drugs
    5613 drugcentral
    The data in this table is sourced from UniChem at EBI.