Dataset

1H nuclear magnetic resonance spectroscopy (1H NMR)

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

Chemical Information

molecular Image
InChI InChI=1S/C11H10BrN/c1-13-8-4-7-11(13)9-5-2-3-6-10(9)12/h2-8H,1H3
SMILES Brc1ccccc1c1cccn1C
InChI Key AAINUPLZMCOTMI-UHFFFAOYSA-N
Molecular Formula C11H10BrN
Exact Mass 236.108 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/AAINUPLZMCOTMI-UHFFFAOYSA-N/CHMO0000593
License URL
Source https://www.chemotion-repository.net/inchikey/AAINUPLZMCOTMI-UHFFFAOYSA-N/CHMO0000593
Version
Author Robert Wolf
Maintainer Chemotion Repository
Language english
MetadataPublished 2025-05-14
Related Molecule
  • 2-(2-bromophenyl)-1-methylpyrrole
    • Field Value
    Measurement Technique 1H nuclear magnetic resonance spectroscopy
    Measurement Variables
    Data-Source Molecule ID Data-Source
    84699225 PubChem
    J3.439.081I Nikkaji
    The data in this table is sourced from UniChem at EBI.