Molecule record

4-methoxycyclohexan-1-one

C7H12O2

128.17 g/mol

Loading structure

Molecular properties

Formula
C7H12O2
Molar mass
128.17 g·mol−1
Exact mass
128.0837 Da
2
PubChem CID
535028

Functional groups

Alkane / alkyl carbon
Ether
Ketone

Physical properties

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

Common names and synonyms

  • 13482-23-0
  • 4-(Methyloxy)cyclohexanone
  • 4-METHOXY-CYCLOHEXANONE
  • 4-Methoxycyclohexanon
  • 4-Methoxycyclohexanone
  • 480-410-8
  • A21968
  • AKOS004905029
Show all 24 synonyms
  • AMY3589
  • CS-W004
  • CS-W004809
  • Cyclohexanone, 4-methoxy-
  • DTXCID40287712
  • DTXSID90336623
  • EN300-59069
  • FT-0692527
  • MFCD01110115
  • PB40355
  • RefChem:99640
  • SCHEMBL473531
  • STL555977
  • SY022709
  • XH1141
  • p-methoxycyclohexanone

Structure identifiers

Canonical SMILES
COC1CCC(=O)CC1
Isomeric SMILES
COC1CCC(=O)CC1
InChI
InChI=1S/C7H12O2/c1-9-7-4-2-6(8)3-5-7/h7H,2-5H2,1H3
InChIKey
XADCKKKOYZJNAR-UHFFFAOYSA-N
PubChem CID
535028

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 4-methoxycyclohexan-1-one; not experimental data.

Simulated EI mass spectrum

On-demand educational fragmentation for 4-methoxycyclohexan-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