Dataset

process

dataset for process

Chemical Information

molecular Image
InChI InChI=1S/C60H55N5/c1-40(50-37-43-25-24-41-20-22-42(23-21-41)26-28-44(50)29-27-43)36-52(59(2,3)39-61)48-32-35-55-53(38-48)60(4,5)51-18-12-13-19-54(51)65(55)49-33-30-47(31-34-49)58-63-56(45-14-8-6-9-15-45)62-57(64-58)46-16-10-7-11-17-46/h6-23,27,29-35,37-38,40,52H,24-26,28,36H2,1-5H3
SMILES N#CC(C(c1ccc2c(c1)C(C)(C)c1c(N2c2ccc(cc2)c2nc(nc(n2)c2ccccc2)c2ccccc2)cccc1)CC(c1cc2CCc3ccc(CCc1cc2)cc3)C)(C)C
InChI Key JIWMTSMBODORIT-UHFFFAOYSA-N
Molecular Formula C60H55N5
Exact Mass 846.112 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/JIWMTSMBODORIT-UHFFFAOYSA-N/BFO0000015.1
License URL
Source https://www.chemotion-repository.net/inchikey/JIWMTSMBODORIT-UHFFFAOYSA-N/BFO0000015.1
Version
Author Henrik Tappert
Maintainer Chemotion Repository
Language english
MetadataPublished 2025-04-22
Related Molecule
  • 3-[10-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-9,9-dimethylacridin-2-yl]-2,2-dimethyl-5-(5-tricyclo[8.2.2.24,7]hexadeca-1(13),4,6,10(14),11,15-hexaenyl)hexanenitrile
    • Field Value
    Measurement Technique process
    Measurement Variables
    title : Dec11-2023

    date : 20231211

    starting time : 16.24 h

    label : HT-143

    id : 118553

    Solvent : CD2Cl2

    temperature : 298.0 K

    PULPROG : zg30

    number of scans : 16 scans

    instrument : Avance NEO

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