Dataset

heteronuclear single quantum coherence (HSQC)

dataset for heteronuclear single quantum coherence (HSQC)

Chemical Information

molecular Image
InChI InChI=1S/C37H29N/c1-2-6-29(7-3-1)30-20-22-32(23-21-30)35-25-33-8-4-5-9-36(33)38-37(35)34-24-28-15-14-26-10-12-27(13-11-26)16-18-31(34)19-17-28/h1-13,17,19-25H,14-16,18H2
SMILES c1ccc(cc1)c1ccc(cc1)c1cc2ccccc2nc1c1cc2ccc1CCc1ccc(CC2)cc1
InChI Key YVWBNKYCOILQOW-UHFFFAOYSA-N
Molecular Formula C37H29N
Exact Mass 487.633 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/YVWBNKYCOILQOW-UHFFFAOYSA-N/CHMO0000604
License URL
Source https://www.chemotion-repository.net/inchikey/YVWBNKYCOILQOW-UHFFFAOYSA-N/CHMO0000604
Version
Author Tilman Hans Köhler
Maintainer Chemotion Repository
Language english
MetadataPublished 2024-05-21
Related Molecule
  • 3-(4-phenylphenyl)-2-(5-tricyclo[8.2.2.24,7]hexadeca-1(13),4,6,10(14),11,15-hexaenyl)quinoline
    • Field Value
    Measurement Technique heteronuclear single quantum coherence
    Measurement Variables
    title : Mar01-2024

    date : 20240302

    starting time : 0.05 h

    label : KT-777

    id : 297655

    Solvent : CD2Cl2

    temperature : 298.0 K

    PULPROG : hsqcedetgpsisp2.3

    number of scans : 4 scans

    instrument : Avance NEO

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