Molecule record

1-phenanthren-3-ylethanone

C16H12O

220.27 g/mol

Loading structure

Molecular properties

Formula
C16H12O
Molar mass
220.27 g·mol−1
Exact mass
220.0888 Da
11
PubChem CID
74867

Functional groups

Alkane / alkyl carbon
Aromatic ring
Ketone

Physical properties

No source-backed physical properties are curated for this molecule yet.

Common names and synonyms

  • 1-(3-Phenanthrenyl)ethanone
  • 1-(3-Phenanthryl)ethanone
  • 1-(3-Phenanthryl)ethanone #
  • 1-(phenanthren-3-yl)ethan-1-one
  • 2039-76-1
  • 218-020-5
  • 3-Acetylphenanthrene
  • 3432AC5C2H
Show all 24 synonyms
  • CHEMBL3186759
  • DTXCID1029099
  • DTXSID9049243
  • EINECS 218-020-5
  • Ethanone, 1-(3-phenanthrenyl)-
  • JKVNPRNAHRHQDD-UHFFFAOYSA-
  • Ketone, methyl 3-phenanthryl
  • MFCD00001169
  • Methyl 3-phenanthryl ketone
  • NSC 3192
  • NSC3192
  • RefChem:815632
  • SCHEMBL30301801
  • SCHEMBL50671
  • STK366110
  • Tox21_202956

Structure identifiers

Canonical SMILES
CC(=O)c1ccc2ccc3ccccc3c2c1
Isomeric SMILES
CC(=O)C1=CC2=C(C=CC3=CC=CC=C32)C=C1
InChI
InChI=1S/C16H12O/c1-11(17)14-9-8-13-7-6-12-4-2-3-5-15(12)16(13)10-14/h2-10H,1H3
InChIKey
JKVNPRNAHRHQDD-UHFFFAOYSA-N
PubChem CID
74867

Spectroscopy

Tabs appear only for spectra stored with clear provenance.

Open library
No redistributable or simulated spectroscopy record is attached yet.

Simulated NMR

On-demand educational prediction for 1-phenanthren-3-ylethanone; not experimental data.

Simulated EI mass spectrum

On-demand educational fragmentation for 1-phenanthren-3-ylethanone; not experimental data.

Sources

Molecule identity

Retrieved 8/20/2026. Reuse status is summarized by the badge; open the source for full details.

Open source record