Dataset

1H nuclear magnetic resonance spectroscopy (1H NMR)

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

Chemical Information

molecular Image
InChI InChI=1S/C26H28Br2/c1-17(2)25(27)23-13-9-21(10-14-23)19-5-7-20(8-6-19)22-11-15-24(16-12-22)26(28)18(3)4/h5-18,25-26H,1-4H3
SMILES BrC(c1ccc(cc1)c1ccc(cc1)c1ccc(cc1)C(C(C)C)Br)C(C)C
InChI Key NGNRXDUETTYMNH-UHFFFAOYSA-N
Molecular Formula C26H28Br2
Exact Mass 500.309 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/NGNRXDUETTYMNH-UHFFFAOYSA-N/CHMO0000593
License URL
Source https://www.chemotion-repository.net/inchikey/NGNRXDUETTYMNH-UHFFFAOYSA-N/CHMO0000593
Version
Author Yannick Matt
Maintainer Chemotion Repository
Language english
MetadataPublished 2020-08-26
Related Molecule
  • 1,4-bis[4-(1-bromo-2-methylpropyl)phenyl]benzene
    • Field Value
    Measurement Technique 1H nuclear magnetic resonance spectroscopy
    Measurement Variables
    Data-Source Molecule ID Data-Source
    154573679 pubchem
    The data in this table is sourced from UniChem at EBI.