Dataset

Carbadox; LC-ESI-QTOF; MS2; 100 V

This MassBank record with Accession MSBNK-BAFG-CSL2311096073 contains the MS2 mass spectrum of Carbadox with the InChIkey BPMVRAQIQQEBLN-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C11H10N4O4/c1-19-11(16)13-12-6-8-7-14(17)9-4-2-3-5-10(9)15(8)18/h2-7,18H,1H3
SMILES COC(=O)N=NC=C1C=[N+]([O-])c2ccccc2N1O
InChI Key BPMVRAQIQQEBLN-UHFFFAOYSA-N
Molecular Formula C11H10N4O4
Exact Mass 262.070 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-BAFG-CSL2311096073
Version
Author
Maintainer
Language
MetadataPublished 2023-11-09
Related Molecule
  • methyl N-[(1-hydroxy-4-oxidoquinoxalin-4-ium-2-ylidene)methylimino]carbamate
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    CHEBI:94744 chebi
    14973511 surechembl
    PD013434 probes_and_drugs
    Molport-042-675-930 molport
    The data in this table is sourced from UniChem at EBI.