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/C15H16N2O2/c18-17(19)14-8-4-7-12-9-10-13(16-15(12)14)11-5-2-1-3-6-11/h4,7-11H,1-3,5-6H2
SMILES [O-][N+](=O)c1cccc2c1nc(cc2)C1CCCCC1
InChI Key YSUUDYJLPDAESC-UHFFFAOYSA-N
Molecular Formula C15H16N2O2
Exact Mass 256.300 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/YSUUDYJLPDAESC-UHFFFAOYSA-N/CHMO0002541
License URL
Source https://www.chemotion-repository.net/inchikey/YSUUDYJLPDAESC-UHFFFAOYSA-N/CHMO0002541
Version
Author Alexander Hoffmann
Maintainer Chemotion Repository
Language english
MetadataPublished 2022-02-18
Related Molecule
  • 2-cyclohexyl-8-nitroquinoline
    • Field Value
    Measurement Technique high-resolution electrospray ionisation time-of-flight mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    3002270 PubChem
    REJVIP CCDC
    The data in this table is sourced from UniChem at EBI.