BMRB

Biological Magnetic Resonance Data Bank


A Repository for Data from NMR Spectroscopy on Proteins, Peptides, Nucleic Acids, and other Biomolecules
Member of WWPDB

Carbazole

Graphical representations:

carbazole image

Molecular Formula: C12 H9 N

Natural Isotopic Abundance Mass: 167.20656

Mono-Isotopic Molecular Masses:

  • C12N14: 167.0734992941
  • C13N14: 179.1137573477
  • C12N15: 168.0705341873
  • C13N15: 180.1107922409

InCHi String: InChI=1S/C12H9N/c1-3-7-11-9(5-1)10-6-2-4-8-12(10)13-11/h1-8,13H

canonical and isomeric SMILES: C1=CC=C2C(=C1)C3=CC=CC=C3N2

PUBCHEM iupac NAME: PUBCHEM iupac TRADITIONAL NAME: PUBCHEM iupac OPENEYE NAME: PUBCHEM iupac CAS NAME: PUBCHEM iupac SYSTEMATIC NAME
9H-carbazole

PubChem Substance (SID):   111677804   14717656   12083266
PubChem Compound (CID):   6854
KEGG: Compound ID   C08060
CAS Registry IDs:   86-74-8
PDB Chemical Component   9CA
Miscellaneous Databases and IDs:   Sigma-Aldrich C5132_SIGMA   EPA DSSTox 33294   ChEBI CHEBI:27543   ZINC ZINC01866749   ChemSpider 11347487   MMDB 42624.16   NMRShiftDB 10006006   MMCD cq_04828   MDL MFCD00004960

Reference data were obtained primarily from the PubChem database.

Three dimensional molecular rendering uses Jmol.