Dataset

1H nuclear magnetic resonance spectroscopy (1H NMR)

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

Chemical Information

molecular Image
InChI InChI=1S/C41H48Br4/c1-25(2)37(42)29-9-17-33(18-10-29)41(34-19-11-30(12-20-34)38(43)26(3)4,35-21-13-31(14-22-35)39(44)27(5)6)36-23-15-32(16-24-36)40(45)28(7)8/h9-28,37-40H,1-8H3
SMILES BrC(c1ccc(cc1)C(c1ccc(cc1)C(C(C)C)Br)(c1ccc(cc1)C(C(C)C)Br)c1ccc(cc1)C(C(C)C)Br)C(C)C
InChI Key PZTBLQNZTKOFMV-UHFFFAOYSA-N
Molecular Formula C41H48Br4
Exact Mass 860.436 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/PZTBLQNZTKOFMV-UHFFFAOYSA-N/CHMO0000593
License URL
Source https://www.chemotion-repository.net/inchikey/PZTBLQNZTKOFMV-UHFFFAOYSA-N/CHMO0000593
Version
Author Yannick Matt
Maintainer Chemotion Repository
Language english
MetadataPublished 2020-08-26
Related Molecule
  • 1-(1-bromo-2-methylpropyl)-4-[tris[4-(1-bromo-2-methylpropyl)phenyl]methyl]benzene
    • Field Value
    Measurement Technique 1H nuclear magnetic resonance spectroscopy
    Measurement Variables
    Data-Source Molecule ID Data-Source
    154573676 pubchem
    The data in this table is sourced from UniChem at EBI.