Dataset

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

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

Chemical Information

molecular Image
InChI InChI=1S/C32H24BrNO2S/c1-35-27-13-9-25(10-14-27)34(26-11-15-28(36-2)16-12-26)24-7-3-21(4-8-24)22-5-17-31-29(19-22)30-20-23(33)6-18-32(30)37-31/h3-20H,1-2H3
SMILES COc1ccc(cc1)N(c1ccc(cc1)OC)c1ccc(cc1)c1ccc2c(c1)c1cc(Br)ccc1s2
InChI Key NBMBLWBOEUGTIB-UHFFFAOYSA-N
Molecular Formula C32H24BrNO2S
Exact Mass 566.507 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/NBMBLWBOEUGTIB-UHFFFAOYSA-N/CHMO0001150
License URL
Source https://www.chemotion-repository.net/inchikey/NBMBLWBOEUGTIB-UHFFFAOYSA-N/CHMO0001150
Version
Author Henrik Tappert
Maintainer Chemotion Repository
Language english
MetadataPublished 2025-02-26
Related Molecule
  • 4-(8-bromodibenzothiophen-2-yl)-N,N-bis(4-methoxyphenyl)aniline
    • Field Value
    Measurement Technique 1H–1H correlation spectroscopy
    Measurement Variables
    title : Oct21-2024

    date : 20241021

    starting time : 11.15 h

    label : HT-1524

    id : 324504

    Solvent : chloroform-D1 (CDCl3)

    temperature : 298.0 K

    PULPROG : cosygpppqf

    number of scans : 1 scans

    instrument : Avance NEO

    Data-Source Molecule ID Data-Source
    No additional information available for this Dataset.