Dataset

mass spectrometry (MS)

dataset for mass spectrometry (MS)

Chemical Information

molecular Image
InChI InChI=1S/C17H24N2O/c1-3-4-5-6-7-10-13-20-17-14(2)18-15-11-8-9-12-16(15)19-17/h8-9,11-12H,3-7,10,13H2,1-2H3
SMILES CCCCCCCCOc1nc2ccccc2nc1C
InChI Key JOUIWYGSYUKEJS-UHFFFAOYSA-N
Molecular Formula C17H24N2O
Exact Mass 272.385 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/JOUIWYGSYUKEJS-UHFFFAOYSA-N/CHMO0000470.1
License URL
Source https://www.chemotion-repository.net/inchikey/JOUIWYGSYUKEJS-UHFFFAOYSA-N/CHMO0000470.1
Version
Author Jérôme Klein
Maintainer Chemotion Repository
Language english
MetadataPublished 2022-04-17
Related Molecule
  • 2-methyl-3-octoxyquinoxaline
    • Field Value
    Measurement Technique mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    163197224 PubChem
    The data in this table is sourced from UniChem at EBI.