Structure Database (LMSD)

Common Name
1-Tridecene
Systematic Name
1-Tridecene
Synonyms
LM ID
LMFA11000331
Formula
C13H26
Exact Mass
Calculate m/z
182.20345
Status
Curated
Show lipids differing only in stereochemistry/bond geometry
View MassBank spectra
View NP-MRD ID(NMR) spectrum
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
Brachyponera sennaarensis (#613778)
Insecta (#50557)
The trail pheromone of the venomous samsum ant, Pachycondyla sennaarensis.,
J Insect Sci, 2011
Pubmed ID: 21529253

String Representations

InChiKey (Click to copy)
VQOXUMQBYILCKR-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C13H26/c1-3-5-7-9-11-13-12-10-8-6-4-2/h3H,1,4-13H2,2H3
SMILES (Click to copy)
C=CCCCCCCCCCCC

Other Databases

HMDB ID
HMDB0030930
CHEBI ID
89815
PubChem CID
17095

Calculated Physicochemical Properties

Heavy Atoms 13
Rings 0
Aromatic Rings 0
Rotatable Bonds 10
Van der Waals Molecular Volume 230.82
Topological Polar Surface Area 0.00
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 0
logP 5.09
Molar Refractivity 62.04

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Created at
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Updated at
6th Jan 2026