Dataset

13C nuclear magnetic resonance spectroscopy (13C NMR)

dataset for 13C nuclear magnetic resonance spectroscopy (13C NMR)

Chemical Information

molecular Image
InChI InChI=1S/C10H8N2/c1-3-7-5-6-8(4-2)10(12)9(7)11/h1-2,5-6H,11-12H2
SMILES C#Cc1ccc(c(c1N)N)C#C
InChI Key WWPJCZYXEZMIBX-UHFFFAOYSA-N
Exact Mass 156.184 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/WWPJCZYXEZMIBX-UHFFFAOYSA-N/CHMO0000595
License URL
Source https://www.chemotion-repository.net/inchikey/WWPJCZYXEZMIBX-UHFFFAOYSA-N/CHMO0000595
Version
Author Laura Holzhauer
Maintainer Chemotion Repository
Language english
MetadataPublished 2025-03-16
Related Molecule
  • 3,6-diethynylbenzene-1,2-diamine
    • Field Value
    Measurement Technique 13C nuclear magnetic resonance spectroscopy
    Measurement Variables
    Data-Source Molecule ID Data-Source
    15750700 surechembl
    90184664 pubchem
    The data in this table is sourced from UniChem at EBI.