Dataset

mass spectrometry (MS)

dataset for mass spectrometry (MS)

Chemical Information

molecular Image
InChI InChI=1S/C12H10N2/c1-4-10-5-6-11-12(7-10)14-9(3)8(2)13-11/h1,5-7H,2-3H3
SMILES C#Cc1ccc2c(c1)nc(c(n2)C)C
InChI Key UQRDWOGEWZKBFW-UHFFFAOYSA-N
Exact Mass 182.221 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/UQRDWOGEWZKBFW-UHFFFAOYSA-N/CHMO0000470
License URL
Source https://www.chemotion-repository.net/inchikey/UQRDWOGEWZKBFW-UHFFFAOYSA-N/CHMO0000470
Version
Author Laura Holzhauer
Maintainer Chemotion Repository
Language english
MetadataPublished 2025-03-17
Related Molecule
  • 6-ethynyl-2,3-dimethylquinoxaline
    • Field Value
    Measurement Technique mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    No additional information available for this Dataset.