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Molecule record

1-methoxy-2-methylpropane

C5H12O

88.15 g/mol

Loading structure

Molecular properties

Formula
C5H12O
Molar mass
88.15 g·mol−1
Exact mass
88.0888 Da
0
PubChem CID
12250

Functional groups

Alkane / alkyl carbon
Ether

Physical properties

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

Common names and synonyms

  • 1-Methoxy-2-methylpropane #
  • 1-methoxy-2-methyl-propane
  • 1Methoxy2methylpropane
  • 3-Methoxy-2-methylpropane
  • 625-44-5
  • 9K4TEE7AED
  • BRN 1730971
  • DTXCID00134031
Show all 24 synonyms
  • DTXSID70211540
  • Ether, isobutyl methyl
  • Isobutyl methyl ether
  • METHYL ISOBUTYL ETHER
  • Methyl isobutyl oxide
  • Propane, 1-methoxy-2-methyl-
  • Propane, 1methoxy2methyl
  • Propane, 1methoxy2methyl (9CI)
  • RefChem:592689
  • SCHEMBL127999
  • SCHEMBL1478858
  • SCHEMBL20100
  • SCHEMBL20101
  • SCHEMBL25403
  • SCHEMBL97635
  • methyl iso-butyl ether

Structure identifiers

Canonical SMILES
COCC(C)C
Isomeric SMILES
CC(C)COC
InChI
InChI=1S/C5H12O/c1-5(2)4-6-3/h5H,4H2,1-3H3
InChIKey
ZYVYEJXMYBUCMN-UHFFFAOYSA-N
PubChem CID
12250

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 1-methoxy-2-methylpropane; not experimental data.

Simulated EI mass spectrum

On-demand educational fragmentation for 1-methoxy-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