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Molecule record

4-tert-butylcyclohexan-1-one

C10H18O

154.25 g/mol

Loading structure

Molecular properties

Formula
C10H18O
Molar mass
154.25 g·mol−1
Exact mass
154.1358 Da
2
PubChem CID
7392

Functional groups

Alkane / alkyl carbon
Ketone

Physical properties

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

Common names and synonyms

  • .gamma.-tert-Butylcyclohexanone
  • 202-678-5
  • 4-(1,1-dimethylethyl)cyclohexanone
  • 4-07-00-00082 (Beilstein Handbook Reference)
  • 4-TERT.BUTYL-CYCLOHEXANONE
  • 4-t-Butylcyclohexanone
  • 4-tert-Butylcyclohexanone
  • 4M45G11K23
Show all 24 synonyms
  • AI3-04092
  • BRN 0507309
  • Cyclohexanone, 4-(1,1-dimethylethyl)-
  • Cyclohexanone, 4-tert-butyl-
  • Cyclohexanone, 4-tert-butyl-(8CI)
  • Cyclohexanone, p-tert-butyl-
  • DTXCID5024394
  • DTXSID7044394
  • EC 202-678-5
  • EINECS 202-678-5
  • InChI=1/C10H18O/c1-10(2,3)8-4-6-9(11)7-5-8/h8H,4-7H2,1-3H
  • NSC 73717
  • RefChem:100518
  • UNII-4M45G11K23
  • gamma-tert-Butylcyclohexanone
  • p-tert-Butylcyclohexanone

Structure identifiers

Canonical SMILES
CC(C)(C)C1CCC(=O)CC1
Isomeric SMILES
CC(C)(C)C1CCC(=O)CC1
InChI
InChI=1S/C10H18O/c1-10(2,3)8-4-6-9(11)7-5-8/h8H,4-7H2,1-3H3
InChIKey
YKFKEYKJGVSEIX-UHFFFAOYSA-N
PubChem CID
7392

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-tert-butylcyclohexan-1-one; not experimental data.

Simulated EI mass spectrum

On-demand educational fragmentation for 4-tert-butylcyclohexan-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.

PubChem(link only)
Open source record