BMRB

Biological Magnetic Resonance Data Bank


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

Fluorene

Graphical representations:

fluorene image

Molecular Formula: C13 H10

Natural Isotopic Abundance Mass: 166.2185

Mono-Isotopic Molecular Masses:

  • C12N14: 166.078250321
  • C13N14: 179.1218632124
  • C12N15: 166.078250321
  • C13N15: 179.1218632124

InCHi String: InChI=1S/C13H10/c1-3-7-12-10(5-1)9-11-6-2-4-8-13(11)12/h1-8H,9H2

canonical and isomeric SMILES: C1C2=CC=CC=C2C3=CC=CC=C31

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

PubChem Substance (SID):   85165305   72745   713866
PubChem Compound (CID):   6853
KEGG: Compound ID   C07715
CAS Registry IDs:   84987-80-4   2299-68-5   86-73-7
PDB Chemical Component   n/a
Miscellaneous Databases and IDs:   Sigma-Aldrich 128333_ALDRICH   ChEBI CHEBI:28266   HSDB 2165   ChemIDplus 002299685   ChemSpider 11500062   EINECS 201-695-5   CCRIS 947   NMRShiftDB 10016530   DTP/NCI 6787   NIST 2587377670   EPA DSSTox 24106   UM-BBD c0388   ChemDB 4987601   NIST Chemistry WebBook 2587377670   MMCD cq_04647   MDL MFCD00001111

Reference data were obtained primarily from the PubChem database.

Three dimensional molecular rendering uses Jmol.