Dataset

1H nuclear magnetic resonance spectroscopy (1H NMR)

dataset for 1H nuclear magnetic resonance spectroscopy (1H NMR)

Chemical Information

molecular Image
InChI InChI=1S/C18H10N4/c1-3-7-17-15(5-1)19-11-13(21-17)9-10-14-12-20-16-6-2-4-8-18(16)22-14/h1-8,11-12H
SMILES c1ccc2c(c1)nc(cn2)C#Cc1cnc2c(n1)cccc2
InChI Key QCKOFEYJROOQPN-UHFFFAOYSA-N
Molecular Formula C18H10N4
Exact Mass 282.299 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/QCKOFEYJROOQPN-UHFFFAOYSA-N/CHMO0000593
License URL
Source https://www.chemotion-repository.net/inchikey/QCKOFEYJROOQPN-UHFFFAOYSA-N/CHMO0000593
Version
Author Victor Larignon
Maintainer Chemotion Repository
Language english
MetadataPublished 2021-10-31
Related Molecule
  • 2-(2-quinoxalin-2-ylethynyl)quinoxaline
    • Field Value
    Measurement Technique 1H nuclear magnetic resonance spectroscopy
    Measurement Variables
    Data-Source Molecule ID Data-Source
    157010408 PubChem
    The data in this table is sourced from UniChem at EBI.