Dataset

mass spectrometry (MS)

dataset for mass spectrometry (MS)

Chemical Information

molecular Image
InChI InChI=1S/C14H19N3O/c1-2-3-4-7-10-15-13-14(18)17-12-9-6-5-8-11(12)16-13/h5-6,8-9H,2-4,7,10H2,1H3,(H,15,16)(H,17,18)
SMILES CCCCCCNc1nc2ccccc2[nH]c1=O
InChI Key PKRKYKKZBDERJN-UHFFFAOYSA-N
Exact Mass 245.320 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/PKRKYKKZBDERJN-UHFFFAOYSA-N/CHMO0000470
License URL
Source https://www.chemotion-repository.net/inchikey/PKRKYKKZBDERJN-UHFFFAOYSA-N/CHMO0000470
Version
Author Laura Holzhauer
Maintainer Chemotion Repository
Language english
MetadataPublished 2025-03-16
Related Molecule
  • 3-(hexylamino)-1H-quinoxalin-2-one
    • Field Value
    Measurement Technique mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    No additional information available for this Dataset.