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Molecule record

2-hydroperoxy-2-methylpropane

C4H10O2

90.12 g/mol

Loading structure

Molecular properties

Formula
C4H10O2
Molar mass
90.12 g·mol−1
Exact mass
90.0681 Da
0
PubChem CID
6410

Functional groups

Alkane / alkyl carbon

Physical properties

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

Common names and synonyms

  • 1,1-Dimethylethyl hydroperoxide
  • 1,1-Dimethylethylhydroperoxide
  • 75-91-2
  • 955VYL842B
  • Cadox TBH
  • DE 488
  • Hydroperoxide, 1,1-dimethylethyl
  • Hydroperoxide, tert-butyl
Show all 24 synonyms
  • Hydroperoxyde de butyle tertiaire
  • KAYABUTYL H 70
  • Luperox TBH 70X
  • NSC-672
  • Perbutyl H
  • Perbutyl H 69T
  • T-Butyl hydroperoxide
  • TBHP
  • TERT-BUTYL HYDROPEROXIDE
  • Terc. butylhydroperoxid
  • Tertiary butyl hydroperoxide
  • Trigonox A-W 70
  • Trigonox a-75
  • t-Butylhydroperoxide
  • terc.Butylhydroperoxid
  • tert-Butylhydroperoxide

Structure identifiers

Canonical SMILES
CC(C)(C)OO
Isomeric SMILES
CC(C)(C)OO
InChI
InChI=1S/C4H10O2/c1-4(2,3)6-5/h5H,1-3H3
InChIKey
CIHOLLKRGTVIJN-UHFFFAOYSA-N
PubChem CID
6410

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-hydroperoxy-2-methylpropane; not experimental data.

Simulated EI mass spectrum

On-demand educational fragmentation for 2-hydroperoxy-2-methylpropane; 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