Molecule record

2-methoxyheptane

C8H18O

130.23 g/mol

Loading structure

Molecular properties

Formula
C8H18O
Molar mass
130.23 g·mol−1
Exact mass
130.1358 Da
0
PubChem CID
13215858

Functional groups

Alkane / alkyl carbon
Ether

Physical properties

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

Common names and synonyms

  • 57858-34-1
  • DTXCID30479700
  • DTXSID00528895
  • RefChem:1063602
  • SCHEMBL383524
  • SCHEMBL386793
  • SCHEMBL6433889
  • SCHEMBL7797806

Structure identifiers

Canonical SMILES
CCCCCC(C)OC
Isomeric SMILES
CCCCCC(C)OC
InChI
InChI=1S/C8H18O/c1-4-5-6-7-8(2)9-3/h8H,4-7H2,1-3H3
InChIKey
XKHTUKHDGNJTLD-UHFFFAOYSA-N
PubChem CID
13215858

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-methoxyheptane; not experimental data.

Simulated EI mass spectrum

On-demand educational fragmentation for 2-methoxyheptane; 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