Dataset

4-Aminoazobenzene; LC-ESI-ITFT; MS2; CE: 35; R=15000; [M+H]+

This MassBank record with Accession MSBNK-UFZ-UF414103 contains the MS2 mass spectrum of 4-Aminoazobenzene with the InChIkey QPQKUYVSJWQSDY-CCEZHUSRSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C12H11N3/c13-10-6-8-12(9-7-10)15-14-11-4-2-1-3-5-11/h1-9H,13H2/b15-14+
SMILES NC1=CC=C(C=C1)\N=N\C1=CC=CC=C1
InChI Key QPQKUYVSJWQSDY-CCEZHUSRSA-N
Molecular Formula C12H11N3
Exact Mass 197.095 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-UF414103
Version
Author
Maintainer
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MetadataPublished 2017-01-05
Related Molecule
  • nfdi4chem-mol25668(Unknown Molecule)
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    CHEBI:233869 chebi
    CHEMBL83761 chembl
    208182 surechembl
    6051 pubchem
    57X2AH42T1 fdasrs
    TABBAD CCDC
    136377 brenda
    141674 brenda
    46984 brenda
    Molport-000-564-806 molport
    The data in this table is sourced from UniChem at EBI.