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/C15H18N2/c16-13-8-4-7-12-9-10-14(17-15(12)13)11-5-2-1-3-6-11/h4,7-11H,1-3,5-6,16H2
SMILES Nc1cccc2c1nc(cc2)C1CCCCC1
InChI Key BRNGTXITIQIEBR-UHFFFAOYSA-N
Molecular Formula C15H18N2
Exact Mass 226.317 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/BRNGTXITIQIEBR-UHFFFAOYSA-N/CHMO0002541
License URL
Source https://www.chemotion-repository.net/inchikey/BRNGTXITIQIEBR-UHFFFAOYSA-N/CHMO0002541
Version
Author Alexander Hoffmann
Maintainer Chemotion Repository
Language english
MetadataPublished 2022-02-18
Related Molecule
  • 2-cyclohexylquinolin-8-amine
    • Field Value
    Measurement Technique high-resolution electrospray ionisation time-of-flight mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    3008477 PubChem
    J3.001.524J Nikkaji
    The data in this table is sourced from UniChem at EBI.