Dataset

13C nuclear magnetic resonance spectroscopy (13C NMR)

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

Chemical Information

molecular Image
InChI InChI=1S/C23H22O/c1-24-22-14-12-21(13-15-22)23-16-19-7-6-17-2-4-18(5-3-17)8-10-20(23)11-9-19/h2-5,9,11-16H,6-8,10H2,1H3
SMILES COc1ccc(cc1)c1cc2CCc3ccc(CCc1cc2)cc3
InChI Key HABAMUPGSLMADN-UHFFFAOYSA-N
Molecular Formula C23H22O
Exact Mass 314.420 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/HABAMUPGSLMADN-UHFFFAOYSA-N/CHMO0000595
License URL
Source https://www.chemotion-repository.net/inchikey/HABAMUPGSLMADN-UHFFFAOYSA-N/CHMO0000595
Version
Author Daniel Knoll
Maintainer Chemotion Repository
Language english
MetadataPublished 2019-12-22
Related Molecule
  • 5-(4-methoxyphenyl)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
    J1.043.513G Nikkaji
    14920996 PubChem
    The data in this table is sourced from UniChem at EBI.