Structure Database (LMSD)

Common Name
9Z,13-Tetradecadien-11-ynal
Systematic Name
9Z,13-Tetradecadien-11-ynal
Synonyms
LM ID
LMFA06000180
Status
Active
Exact Mass
Calculate m/z
204.151415
Formula
Abbrev


Download as...
MDLMOL SDF CSV TSV
MDLMOL files can be opened in various drawing programs. In ChemDraw, open as filetype "MDL Molfile".

Main

Classification

String Representations

InChiKey (Click to copy)
VHKRYAJKUGIJBD-WAYWQWQTSA-N
InChi (Click to copy)
InChI=1S/C14H20O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15/h2,5-6,14H,1,7-13H2/b6-5-
SMILES (Click to copy)
C(CCCCCCC/C=C\C#CC=C)(=O)[H]

References

Comments
Pherobase

Taxonomy Information

Curated from
NCBI taxonomy class
Reference
Stenoma catenifer (#1921420)
Insecta (#50557)
(9Z)-9,13-Tetradecadien-11-ynal, the sex pheromone of the avocado seed moth, Stenoma catenifer,
Tetrahedron Letts, 2008

Other Databases

PubChem CID

Calculated Physicochemical Properties

Heavy Atoms 15
Rings 0
Aromatic Rings 0
Rotatable Bonds 8
Van der Waals Molecular Volume 246.35
Topological Polar Surface Area 17.07
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 1
logP 3.66
Molar Refractivity 65.50

Admin

Created at
-
Updated at
4th Apr 2022