Structure Database (LMSD)

O O
Common Name
4Z-Tridecenyl acetate
Systematic Name
4Z-Tridecenyl acetate
Synonyms
LM ID
LMFA07010274
Formula
C15H28O2
Exact Mass
Calculate m/z
240.20893
Sum Composition
SFE 15:1
Status
Active
Show lipids differing only in stereochemistry/bond geometry

Main

Classification

Category
Main Class
Sub Class
Fatty Acyls [FA]
Fatty Acids and Conjugates [FA01]
Unsaturated fatty acids [FA0103]
Fatty esters [FA07]
Short fatty esters [FA0710]

String Representations

InChiKey (Click to copy)
DUCVQKMNGSZPAV-KHPPLWFESA-N
InChi (Click to copy)
InChI=1S/C15H28O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-17-15(2)16/h10-11H,3-9,12-14H2,1-2H3/b11-10-
SMILES (Click to copy)
O(C(=O)C)CCC/C=C\CCCCCCCC

References

Comments
Pherobase

Taxonomy Information

Curated from
NCBI taxonomy class
Reference
Lepidoptera (#7088)
Insecta (#50557)
New sex attractants for male Lepidoptera (Coleophoridae, Gelechiidae, Momphidae, Oecophoridae, and Yponomeutidae) found by field screening in The Netherlands,
J. Appl. Entomol, 1987

Other Databases

PubChem CID
5365747

Calculated Physicochemical Properties

Heavy Atoms 17
Rings 0
Aromatic Rings 0
Rotatable Bonds 12
Van der Waals Molecular Volume 280.36
Topological Polar Surface Area 26.30
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 2
logP 4.92
Molar Refractivity 73.49

Admin

Created at
-
Updated at
4th Oct 2022