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Spectral Data   Additional Data   Download  
Molecule
10016515
Chemical name(s)phenanthrene
Chemical formulaC14H10
Molecular weight178.229
Number of double bond equivalents (DBEs)10.0
Number of all rings, size of smallest set of smallest rings6, 3
Canonical name(s)
CAS-Number 85-01-8
Additional information ChEBI;
Links from Unichem: ChEMBL;PDBe (Protein Data Bank Europe);KEGG (Kyoto Encyclopedia of Genes and Genomes) Ligand;ChEBI (Chemical Entities of Biological Interest).;ZINC;eMolecules;IBM strategic IP insight platform and the... (truncated)
Molecule keywords
DOI
13C Spectrum
10038554 Rating: 10
Type13C
Measurement conditions
Temperature [K]Unreported
SolventUnreported
Field Strength [MHz]Unreported
Assignment MethodUnreported
Literature S. Berger; S. Braun; H.-O. Kalinowski: 13-C-NMR-Spektroskopie, New York: Thieme Verlag 1984.
Additional comments871.MOL; Multiplicities generated automatically from H count
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