Molecule record

pentadecane-1-thiol

C15H32S

244.49 g/mol

Loading structure

Molecular properties

Formula
C15H32S
Molar mass
244.49 g·mol−1
Exact mass
244.2225 Da
0
PubChem CID
91373

Functional groups

Alkane / alkyl carbon
Thiol

Physical properties

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

Common names and synonyms

  • 1-Pentadecanethiol
  • 1-Pentadecanethiol, >=97%
  • 15-Mercaptopentadecane
  • 1Pentadecanethiol
  • 246-785-5
  • 25276-70-4
  • AKOS028108541
  • C15H32S
Show all 24 synonyms
  • DTXCID60102413
  • DTXSID00179922
  • EINECS 246-785-5
  • FP62975
  • MFCD00059147
  • N-PENTADECYL MERCAPTAN 98+%
  • N-PENTADECYLMERCAPTAN
  • Pentadecyl Mercaptan
  • RefChem:859720
  • SCHEMBL133112
  • SCHEMBL133113
  • SCHEMBL20473157
  • SCHEMBL2797282
  • SY053832
  • n-Pentadecyl Mercaptan
  • pentadecan-1-thiol

Structure identifiers

Canonical SMILES
CCCCCCCCCCCCCCCS
Isomeric SMILES
CCCCCCCCCCCCCCCS
InChI
InChI=1S/C15H32S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16/h16H,2-15H2,1H3
InChIKey
IGMQODZGDORXEN-UHFFFAOYSA-N
PubChem CID
91373

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 pentadecane-1-thiol; not experimental data.

Simulated EI mass spectrum

On-demand educational fragmentation for pentadecane-1-thiol; 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