Dataset

13C nuclear magnetic resonance spectroscopy (13C NMR)

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

Chemical Information

molecular Image
InChI InChI=1S/C25H23N3O/c1-29-23-14-12-22(13-15-23)28-25(17-26-27-28)24-16-20-7-6-18-2-4-19(5-3-18)8-10-21(24)11-9-20/h2-5,9,11-17H,6-8,10H2,1H3
SMILES COc1ccc(cc1)n1nncc1c1cc2CCc3ccc(CCc1cc2)cc3
InChI Key UIUPXPAOUNCBNR-UHFFFAOYSA-N
Molecular Formula C25H23N3O
Exact Mass 381.470 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/UIUPXPAOUNCBNR-UHFFFAOYSA-N/13CNMR.1
License URL
Source https://www.chemotion-repository.net/inchikey/UIUPXPAOUNCBNR-UHFFFAOYSA-N/13CNMR.1
Version
Author Simone Gräßle
Maintainer Chemotion Repository
Language english
MetadataPublished 2020-02-11
Related Molecule
  • 1-(4-methoxyphenyl)-5-(5-tricyclo[8.2.2.24,7]hexadeca-1(13),4,6,10(14),11,15-hexaenyl)triazole
    • Field Value
    Measurement Technique 13C nuclear magnetic resonance spectroscopy
    Measurement Variables
    Data-Source Molecule ID Data-Source
    145915838 PubChem
    The data in this table is sourced from UniChem at EBI.