Dataset

high-resolution electrospray ionisation time-of-flight mass spectrometry (HR-ESI-TOF-MS)

dataset for high-resolution electrospray ionisation time-of-flight mass spectrometry (HR-ESI-TOF-MS)

Chemical Information

molecular Image
InChI InChI=1S/C7H7NO/c9-8-6-7-4-2-1-3-5-7/h1-6,9H/b8-6+
SMILES O/N=C/c1ccccc1
InChI Key VTWKXBJHBHYJBI-SOFGYWHQSA-N
Exact Mass 121.137 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/VTWKXBJHBHYJBI-SOFGYWHQSA-N/CHMO0002541
License URL
Source https://www.chemotion-repository.net/inchikey/VTWKXBJHBHYJBI-SOFGYWHQSA-N/CHMO0002541
Version
Author Robert Göstl
Maintainer Chemotion Repository
Language english
MetadataPublished 2025-11-03
Related Molecule
  • (NE)-N-benzylidenehydroxylamine
    • Field Value
    Measurement Technique CHMO:0002541
    Measurement Variables
    Data-Source Molecule ID Data-Source
    CHEMBL135583 chembl
    266504 surechembl
    5324611 pubchem
    TBP7JJ5HTH fdasrs
    PD220868 probes_and_drugs
    CAHDAQ CCDC
    258989 brenda
    259964 brenda
    Molport-000-883-500 molport
    The data in this table is sourced from UniChem at EBI.