Structure database (LMSD)

  MDLMOL files can be opened in various drawing programs. In ChemDraw, open as filetype "MDL Molfile".
LM IDLMFA11000050
Common Name4,6-Dimethyl-2E,4E,6E-nonatriene
Systematic Name4,6-Dimethyl-2E,4E,6E-nonatriene
Synonyms-
Exact Mass
150.1409 (neutral)    Calculate m/z:
FormulaC11H18
CategoryFatty Acyls [FA]
Main ClassHydrocarbons [FA11]
Sub Class-
PubChem CID56936063
InChIKeyTZSBLOZYIXZKCN-MROCENOWSA-N  Show lipids differing only in stereochemistry/bond geometry
InChIInChI=1S/C11H18/c1-5-7-10(3)9-11(4)8-6-2/h5,7-9H,6H2,1-4H3/b7-5+,10-9+,11-8+
SMILESC/C=C/C(/C)=C/C(/C)=C/CC
StatusActive
CommentsPherobase Semiochemicals
Calculated physicochemical properties (?):
 Heavy Atoms11Rings0Aromatic Rings0Rotatable Bonds3
 van der Waals
Molecular Volume
190.94Topological Polar
Surface Area
0.00Hydrogen
Bond Donors
0Hydrogen
Bond Acceptors
0
 logP3.87Molar
Refractivity
52.62