Structure database (LMSD)

  MDLMOL files can be opened in various drawing programs. In ChemDraw, open as filetype "MDL Molfile".
LM IDLMFA11000052
Common Name5-Ethyl-7-methyl-3E,5E,7E-undecatriene
Systematic Name5-Ethyl-7-methyl-3E,5E,7E-undecatriene
Synonyms-
Exact Mass
192.1878 (neutral)    Calculate m/z:
FormulaC14H24
CategoryFatty Acyls [FA]
Main ClassHydrocarbons [FA11]
Sub Class-
PubChem CID56936064
InChIKeyWELYARNIAKLKDT-OBZGEHOJSA-N  Show lipids differing only in stereochemistry/bond geometry
InChIInChI=1S/C14H24/c1-5-8-10-13(4)12-14(7-3)11-9-6-2/h9-12H,5-8H2,1-4H3/b11-9+,13-1
0+,14-12+
SMILESCC/C=C/C(/CC)=C/C(/C)=C/CCC
StatusActive
CommentsPherobase Semiochemicals
Calculated physicochemical properties (?):
 Heavy Atoms14Rings0Aromatic Rings0Rotatable Bonds6
 van der Waals
Molecular Volume
242.84Topological Polar
Surface Area
0.00Hydrogen
Bond Donors
0Hydrogen
Bond Acceptors
0
 logP5.04Molar
Refractivity
66.47