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Molecule record

methyl nonanoate

C10H20O2

172.27 g/mol

Loading structure

Molecular properties

Formula
C10H20O2
Molar mass
172.27 g·mol−1
Exact mass
172.1463 Da
1
PubChem CID
15606

Functional groups

Alkane / alkyl carbon
Ester
Ether

Physical properties

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

Common names and synonyms

  • 1731-84-6
  • 217-052-7
  • 7XKD6QOH68
  • AI3-28570
  • BRN 1754521
  • C09 FAME
  • CHEBI:44499
  • DTXCID6035522
Show all 24 synonyms
  • DTXSID8061921
  • EINECS 217-052-7
  • FEMA No. 2724
  • InChI=1/C10H20O2/c1-3-4-5-6-7-8-9-10(11)12-2/h3-9H2,1-2H
  • METHYL NONANOATE [FHFI]
  • METHYL PELARGONATE [INCI]
  • MFCD00009569
  • Methyl ester nonanoic acid
  • Methyl ester of nonanoic acid
  • Methyl n-nonanoate
  • Methyl nonylate
  • Methyl pelargonate
  • Nonanoic acid, methyl ester
  • Pelargonic acid methyl ester
  • RefChem:817985
  • methylnonanoate

Structure identifiers

Canonical SMILES
CCCCCCCCC(=O)OC
Isomeric SMILES
CCCCCCCCC(=O)OC
InChI
InChI=1S/C10H20O2/c1-3-4-5-6-7-8-9-10(11)12-2/h3-9H2,1-2H3
InChIKey
IJXHLVMUNBOGRR-UHFFFAOYSA-N
PubChem CID
15606

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 methyl nonanoate; not experimental data.

Simulated EI mass spectrum

On-demand educational fragmentation for methyl nonanoate; 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