Dataset

correlation spectroscopy (COSY)

dataset for correlation spectroscopy (COSY)

Chemical Info

molecular Image
InChI InChI=1S/C28H29N/c1-2-3-4-22-13-16-27-25(17-22)19-28(29-27)26-18-23-10-9-20-5-7-21(8-6-20)11-14-24(26)15-12-23/h5-8,12-13,15-19,29H,2-4,9-11,14H2,1H3
SMILES CCCCc1ccc2c(c1)cc([nH]2)c1cc2ccc1CCc1ccc(CC2)cc1
InChI Key IXQZQCNFGYGWCX-UHFFFAOYSA-N
Molecular Formula C28H29N
Exact Mass 379.537 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/IXQZQCNFGYGWCX-UHFFFAOYSA-N/CHMO0000599
License URL
Source https://www.chemotion-repository.net/inchikey/IXQZQCNFGYGWCX-UHFFFAOYSA-N/CHMO0000599
Version
Author Tilman Hans Köhler
Maintainer Chemotion Repository
Language english
MetadataPublished 2024-05-21
Related Molecule
  • 5-butyl-2-(5-tricyclo[8.2.2.24,7]hexadeca-1(13),4,6,10(14),11,15-hexaenyl)-1H-indole
    • Field Value
    Measurement Technique correlation spectroscopy
    Measurement Variables
    temperature : 298.0 K

    PULPROG : cosygpppqf

    number of scans : 1 scans

    title : Mar05-2024

    date : 20240305

    starting time : 11.47 h

    instrument : Avance NEO

    label : KT-767

    id : 297249

    Solvent : chloroform-D1 (CDCl3)

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