Molecule record

octadec-2-yne

C18H34

250.47 g/mol

Loading structure

Molecular properties

Formula
C18H34
Molar mass
250.47 g·mol−1
Exact mass
250.2661 Da
2
PubChem CID
521992

Functional groups

Alkane / alkyl carbon
Alkyne

Physical properties

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

Common names and synonyms

  • 2-Octadecyne
  • 61847-97-0
  • DTXSID201351208
  • SCHEMBL1792259
  • SCHEMBL512564
  • SCHEMBL5166993
  • SCHEMBL5985868
  • SCHEMBL9250878
Show all 9 synonyms
  • SCHEMBL9523655

Structure identifiers

Canonical SMILES
CC#CCCCCCCCCCCCCCCC
Isomeric SMILES
CCCCCCCCCCCCCCCC#CC
InChI
InChI=1S/C18H34/c1-3-5-7-9-11-13-15-17-18-16-14-12-10-8-6-4-2/h3,5,7-18H2,1-2H3
InChIKey
WXNOCMKVJXUPOC-UHFFFAOYSA-N
PubChem CID
521992

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 octadec-2-yne; not experimental data.

Simulated EI mass spectrum

On-demand educational fragmentation for octadec-2-yne; not experimental data.

Sources

Molecule identity

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

Open source record