Dataset

13C nuclear magnetic resonance spectroscopy (13C NMR)

dataset for 13C nuclear magnetic resonance spectroscopy (13C NMR)

Chemical Information

molecular Image
InChI InChI=1S/C25H26/c1-17-14-18(2)25(19(3)15-17)24-16-22-9-8-20-4-6-21(7-5-20)10-12-23(24)13-11-22/h4-7,11,13-16H,8-10,12H2,1-3H3
SMILES Cc1cc(C)c(c(c1)C)c1cc2ccc1CCc1ccc(CC2)cc1
InChI Key OTIFGUKLKCKZPR-UHFFFAOYSA-N
Molecular Formula C25H26
Exact Mass 326.474 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/OTIFGUKLKCKZPR-UHFFFAOYSA-N/CHMO0000595
License URL
Source https://www.chemotion-repository.net/inchikey/OTIFGUKLKCKZPR-UHFFFAOYSA-N/CHMO0000595
Version
Author Daniel Knoll
Maintainer Chemotion Repository
Language english
MetadataPublished 2020-05-21
Related Molecule
  • 5-(2,4,6-trimethylphenyl)tricyclo[8.2.2.24,7]hexadeca-1(13),4,6,10(14),11,15-hexaene
    • Field Value
    Measurement Technique 13C nuclear magnetic resonance spectroscopy
    Measurement Variables
    Data-Source Molecule ID Data-Source
    13617634 pubchem
    CAHHID CCDC
    The data in this table is sourced from UniChem at EBI.