Dataset

1H nuclear magnetic resonance spectroscopy (1H NMR)

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

Chemical Information

molecular Image
InChI InChI=1S/C8H8Br2/c9-6-8(10)7-4-2-1-3-5-7/h1-5,8H,6H2
SMILES BrCC(c1ccccc1)Br
InChI Key SHKKTLSDGJRCTR-UHFFFAOYSA-N
Molecular Formula C8H8Br2
Exact Mass 263.957 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/SHKKTLSDGJRCTR-UHFFFAOYSA-N/CHMO0000593
License URL
Source https://www.chemotion-repository.net/inchikey/SHKKTLSDGJRCTR-UHFFFAOYSA-N/CHMO0000593
Version
Author Michael Konstantinos Bogdos
Maintainer Chemotion Repository
Language english
MetadataPublished 2022-11-21
Related Molecule
  • 1,2-dibromoethylbenzene
    • Field Value
    Measurement Technique 1H nuclear magnetic resonance spectroscopy
    Measurement Variables
    Data-Source Molecule ID Data-Source
    331173 surechembl
    7145 pubchem
    PUE9VR0TBW fdasrs
    DTXSID7052735 comptox
    Molport-001-768-414 molport
    The data in this table is sourced from UniChem at EBI.