Dataset

Dichlorobenzimidazole Riboside, DRB (5,6-Dichloro-1-b-D-ribofuranosylbenzimidazole); LC-APCI-QTOF; MS; POSITIVE

This MassBank record with Accession MSBNK-Washington_State_Univ-BML81087 contains the MS mass spectrum of Dichlorobenzimidazole Riboside, DRB (5,6-Dichloro-1-b-D-ribofuranosylbenzimidazole) with the InChIkey XHSQDZXAVJRBMX-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C12H12Cl2N2O4/c13-5-1-7-8(2-6(5)14)16(4-15-7)12-11(19)10(18)9(3-17)20-12/h1-2,4,9-12,17-19H,3H2
SMILES C1=C2C(=CC(=C1Cl)Cl)N(C=N2)C3C(C(C(O3)CO)O)O
InChI Key XHSQDZXAVJRBMX-UHFFFAOYSA-N
Molecular Formula C12H12Cl2N2O4
Exact Mass 318.017 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-Washington_State_Univ-BML81087
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MetadataPublished 2016-01-19
Related Molecule
  • 2-(5,6-dichlorobenzimidazol-1-yl)-5-(hydroxymethyl)oxolane-3,4-diol
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    HMDB0242505 Human Metabolome Database
    CHEMBL267071 ChEMBL
    3165 PubChem
    53-85-0 ACToR
    PD024277 ProbesDrugs
    1986633 eMolecules
    SCHEMBL20419020 SureChEMBL
    The data in this table is sourced from UniChem at EBI.