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/C6H2Br2N2O4/c7-3-1-5(9(11)12)6(10(13)14)2-4(3)8/h1-2H
SMILES Brc1cc([N+](=O)[O-])c(cc1Br)[N+](=O)[O-]
InChI Key DOPFANUPBFALEA-UHFFFAOYSA-N
Molecular Formula C6H2Br2N2O4
Exact Mass 325.899 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/DOPFANUPBFALEA-UHFFFAOYSA-N/CHMO0001146
License URL
Source https://www.chemotion-repository.net/inchikey/DOPFANUPBFALEA-UHFFFAOYSA-N/CHMO0001146
Version
Author Lukas Langer
Maintainer Chemotion Repository
Language english
MetadataPublished 2025-03-07
Related Molecule
  • 1,2-dibromo-4,5-dinitrobenzene
    • Field Value
    Measurement Technique 1H–13C heteronuclear single quantum coherence
    Measurement Variables
    Data-Source Molecule ID Data-Source
    12196943 PubChem
    SCHEMBL2249179 SureChEMBL
    ZINC000118429476 ZINC
    The data in this table is sourced from UniChem at EBI.