Dataset

1H--13C heteronuclear single quantum coherence (1H-13C HSQC)

dataset for 1H--13C heteronuclear single quantum coherence (1H-13C HSQC)

Chemical Information

molecular Image
InChI InChI=1S/C8H7N5/c1-2-4-7-6(3-1)9-5-8-10-11-12-13(7)8/h1-4,9H,5H2
SMILES c1ccc2c(-n3nnnc3CN2)c1
InChI Key JJCQHCJBVSOFTM-UHFFFAOYSA-N
Molecular Formula C8H7N5
Exact Mass 173.175 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/JJCQHCJBVSOFTM-UHFFFAOYSA-N/CHMO0001146
License URL
Source https://www.chemotion-repository.net/inchikey/JJCQHCJBVSOFTM-UHFFFAOYSA-N/CHMO0001146
Version
Author Laura Holzhauer
Maintainer Chemotion Repository
Language english
MetadataPublished 2022-02-11
Related Molecule
  • 4,5-dihydrotetrazolo[1,5-a]quinoxaline
    • Field Value
    Measurement Technique 1H–13C heteronuclear single quantum coherence
    Measurement Variables
    Data-Source Molecule ID Data-Source
    9986581 surechembl
    21514049 pubchem
    DTXSID20615397 comptox
    The data in this table is sourced from UniChem at EBI.