Molecule record

2-methylcyclooctan-1-one

C9H16O

140.23 g/mol

Loading structure

Molecular properties

Formula
C9H16O
Molar mass
140.23 g·mol−1
Exact mass
140.1201 Da
2
PubChem CID
272736

Functional groups

Alkane / alkyl carbon
Ketone

Physical properties

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

Common names and synonyms

  • 10363-27-6
  • 2-Methylcyclooctane
  • 2-Methylcyclooctanone
  • 2-methyl-cyclooctanone
  • 4BJ8TX8U53
  • 652-072-3
  • AKOS024333672
  • Cyclooctanone, 2-methyl-
Show all 18 synonyms
  • DB-240374
  • DTXSID301377087
  • MFCD00184955
  • MJFJFHJQZCMMKL-UHFFFAOYSA-N
  • NSC 117419
  • NSC117419
  • RefChem:475857
  • SCHEMBL2348541
  • SCHEMBL27459629
  • SY274314

Structure identifiers

Canonical SMILES
CC1CCCCCCC1=O
Isomeric SMILES
CC1CCCCCCC1=O
InChI
InChI=1S/C9H16O/c1-8-6-4-2-3-5-7-9(8)10/h8H,2-7H2,1H3
InChIKey
MJFJFHJQZCMMKL-UHFFFAOYSA-N
PubChem CID
272736

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 2-methylcyclooctan-1-one; not experimental data.

Simulated EI mass spectrum

On-demand educational fragmentation for 2-methylcyclooctan-1-one; 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