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/C13H16N2/c1-13(2,3)11-8-7-9-5-4-6-10(14)12(9)15-11/h4-8H,14H2,1-3H3
SMILES Nc1cccc2c1nc(cc2)C(C)(C)C
InChI Key MTPUXEIATOHPCE-UHFFFAOYSA-N
Molecular Formula C13H16N2
Exact Mass 200.280 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/MTPUXEIATOHPCE-UHFFFAOYSA-N/CHMO0002541
License URL
Source https://www.chemotion-repository.net/inchikey/MTPUXEIATOHPCE-UHFFFAOYSA-N/CHMO0002541
Version
Author Alexander Hoffmann
Maintainer Chemotion Repository
Language english
MetadataPublished 2022-02-18
Related Molecule
  • 2-tert-butylquinolin-8-amine
    • Field Value
    Measurement Technique high-resolution electrospray ionisation time-of-flight mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    119094982 PubChem
    The data in this table is sourced from UniChem at EBI.