Dataset

13C nuclear magnetic resonance spectroscopy (13C NMR)

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

Chemical Information

molecular Image
InChI InChI=1S/C9H10Br2O/c1-6(12-2)8-5-7(10)3-4-9(8)11/h3-6H,1-2H3/t6-/m0/s1
SMILES C[C@@H](c1cc(Br)ccc1Br)OC
InChI Key RNLYINNBMKDNJK-LURJTMIESA-N
Molecular Formula C9H10Br2O
Exact Mass 293.983 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/RNLYINNBMKDNJK-LURJTMIESA-N/CHMO0000595
License URL
Source https://www.chemotion-repository.net/inchikey/RNLYINNBMKDNJK-LURJTMIESA-N/CHMO0000595
Version
Author Christoph Zippel
Maintainer Chemotion Repository
Language english
MetadataPublished 2020-01-03
Related Molecule
  • 1,4-dibromo-2-[(1S)-1-methoxyethyl]benzene
    • Field Value
    Measurement Technique 13C nuclear magnetic resonance spectroscopy
    Measurement Variables
    Data-Source Molecule ID Data-Source
    145721701 PubChem
    The data in this table is sourced from UniChem at EBI.