Dataset

1H--1H correlation spectroscopy (1H-1H COSY)

dataset for 1H--1H correlation spectroscopy (1H-1H COSY)

Chemical Information

molecular Image
InChI InChI=1S/C36H27N/c1-4-10-28(11-5-1)31-16-22-34(23-17-31)37(35-24-18-32(19-25-35)29-12-6-2-7-13-29)36-26-20-33(21-27-36)30-14-8-3-9-15-30/h1-27H
SMILES c1ccc(cc1)c1ccc(cc1)N(c1ccc(cc1)c1ccccc1)c1ccc(cc1)c1ccccc1
InChI Key RORPOZIIMCFMFH-UHFFFAOYSA-N
Molecular Formula C36H27N
Exact Mass 473.606 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/RORPOZIIMCFMFH-UHFFFAOYSA-N/CHMO0001150
License URL
Source https://www.chemotion-repository.net/inchikey/RORPOZIIMCFMFH-UHFFFAOYSA-N/CHMO0001150
Version
Author Ksenia Kutonova
Maintainer Chemotion Repository
Language english
MetadataPublished 2020-04-08
Related Molecule
  • 4-phenyl-N,N-bis(4-phenylphenyl)aniline
    • Field Value
    Measurement Technique 1H–1H correlation spectroscopy
    Measurement Variables
    Data-Source Molecule ID Data-Source
    SCHEMBL804835 SureChEMBL
    18435272 PubChem
    WEHLIE CCDC
    CB93147644 ChemicalBook
    DTXSID60593741 EPA CompTox Dashboard
    J954.843B Nikkaji
    The data in this table is sourced from UniChem at EBI.