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/C7H6N2O3/c10-8-5-6-2-1-3-7(4-6)9(11)12/h1-5,10H/b8-5+
SMILES O/N=C/c1cccc(c1)[N+](=O)[O-]
InChI Key GQMMRLBWXCGBEV-VMPITWQZSA-N
Exact Mass 166.134 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/GQMMRLBWXCGBEV-VMPITWQZSA-N/CHMO0002541
License URL
Source https://www.chemotion-repository.net/inchikey/GQMMRLBWXCGBEV-VMPITWQZSA-N/CHMO0002541
Version
Author Robert Göstl
Maintainer Chemotion Repository
Language english
MetadataPublished 2025-11-03
Related Molecule
  • (NE)-N-[(3-nitrophenyl)methylidene]hydroxylamine
    • Field Value
    Measurement Technique CHMO:0002541
    Measurement Variables
    Data-Source Molecule ID Data-Source
    492347 eMolecules
    5354053 PubChem
    16032590 PubChem: Thomson Pharma
    NUQJEP CCDC
    ZINC000018173464 ZINC
    SCHEMBL472607 SureChEMBL
    MCULE-7077303837 Mcule
    20112323 NMRShiftDB
    The data in this table is sourced from UniChem at EBI.