Structure Database (LMSD)

Common Name
Tetradecane
Systematic Name
Tetradecane
Synonyms
LM ID
LMFA11000586
Formula
C14H30
Exact Mass
Calculate m/z
198.234751
Status
Curated
Show lipids differing only in stereochemistry/bond geometry
View MassBank spectra
View studies deposited in Metabolomics Workbench in which this molecule has been identified

Classification

Category
Main Class
Sub Class
Fatty Acyls [FA]
Hydrocarbons [FA11]

References

Comments
Pherobase Semiochemicals

Taxonomy Information

Curated from
NCBI taxonomy class
Reference
Polyrhachis (#84544)
Insecta (#50557)
Volatile constituents of two species of Australian formicine ants of the genera Notoncus and Polyrhachis,
Insect Biochem, 1982

String Representations

InChiKey (Click to copy)
BGHCVCJVXZWKCC-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C14H30/c1-3-5-7-9-11-13-14-12-10-8-6-4-2/h3-14H2,1-2H3
SMILES (Click to copy)
CCCCCCCCCCCCCC

Other Databases

HMDB ID
HMDB0059907
CHEBI ID
41253
PubChem CID
12389
PDB ID
C14

Calculated Physicochemical Properties

Heavy Atoms 14
Rings 0
Aromatic Rings 0
Rotatable Bonds 11
Van der Waals Molecular Volume 250.76
Topological Polar Surface Area 0.00
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 0
logP 5.71
Molar Refractivity 66.75

Admin

Created at
-
Updated at
17th Nov 2025