Dataset

13C nuclear magnetic resonance spectroscopy (13C NMR)

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

Chemical Information

molecular Image
InChI InChI=1S/C18H12N2/c1-3-7-15-11(5-1)13-9-18-14(10-17(13)19-15)12-6-2-4-8-16(12)20-18/h1-10,19-20H
SMILES c1ccc2c(c1)c1cc3[nH]c4c(c3cc1[nH]2)cccc4
InChI Key YCPBCVTUBBBNJJ-UHFFFAOYSA-N
Molecular Formula C18H12N2
Exact Mass 256.301 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/YCPBCVTUBBBNJJ-UHFFFAOYSA-N/CHMO0000595.1
License URL
Source https://www.chemotion-repository.net/inchikey/YCPBCVTUBBBNJJ-UHFFFAOYSA-N/CHMO0000595.1
Version
Author Laura Holzhauer
Maintainer Chemotion Repository
Language english
MetadataPublished 2025-03-16
Related Molecule
  • 5,11-dihydroindolo[3,2-b]carbazole
    • Field Value
    Measurement Technique 13C nuclear magnetic resonance spectroscopy
    Measurement Variables
    Data-Source Molecule ID Data-Source
    CHEMBL509307 chembl
    29380459 surechembl
    550602 surechembl
    95838 pubchem
    VARMUY CCDC
    Molport-003-993-605 molport
    50612688 bindingdb
    The data in this table is sourced from UniChem at EBI.