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Molecule record

2-tert-butylsulfanyl-2-methylpropane

C8H18S

146.30 g/mol

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Molecular properties

Formula
C8H18S
Molar mass
146.30 g·mol−1
Exact mass
146.1129 Da
0
PubChem CID
7872

Functional groups

Alkane / alkyl carbon
Sulfide

Physical properties

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

Common names and synonyms

  • 107-47-1
  • 2,2'-thiobis(2-methylpropane)
  • 2,2,4,4-Tetramethyl-3-thiapentane
  • 2,2,4,4Tetramethyl3thiapentane
  • 203-493-2
  • DTXCID901887
  • DTXSID5021887
  • Di-tert-butyl sulfide
Show all 24 synonyms
  • Di-tert-butyl sulphide
  • Ditertbutyl sulphide
  • EINECS 203-493-2
  • InChI=1/C8H18S/c1-7(2,3)9-8(4,5)6/h1-6H
  • MFCD00008839
  • NSC 4549
  • NSC4549
  • Propane, 2,2'-thiobis[2-methyl-
  • Propane, 2,2'thiobis(2methyl
  • RefChem:868834
  • SCHEMBL400906
  • t-Butyl sulfide
  • tert-Butyl sulfide
  • tert-Butyl sulfide (8CI)
  • tertButyl sulfide
  • tertButyl sulfide (8CI)

Structure identifiers

Canonical SMILES
CC(C)(C)SC(C)(C)C
Isomeric SMILES
CC(C)(C)SC(C)(C)C
InChI
InChI=1S/C8H18S/c1-7(2,3)9-8(4,5)6/h1-6H3
InChIKey
LNMBCRKRCIMQLW-UHFFFAOYSA-N
PubChem CID
7872

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-tert-butylsulfanyl-2-methylpropane; not experimental data.

Simulated EI mass spectrum

On-demand educational fragmentation for 2-tert-butylsulfanyl-2-methylpropane; not experimental data.

Sources

Molecule identity

Retrieved 8/19/2026. Reuse status is summarized by the badge; open the source for full details.

PubChem(link only)
Open source record