Structure database (LMSD)

  MDLMOL files can be opened in various drawing programs. In ChemDraw, open as filetype "MDL Molfile".
LM IDLMFA11000040
Common Name7,11-Dimethyl-3-methylene-1,6E,10-dodecatriene
Systematic Name7,11-Dimethyl-3-methylene-1,6E,10-dodecatriene
Synonyms-
Exact Mass
204.1878 (neutral)    Calculate m/z:
FormulaC15H24
CategoryFatty Acyls [FA]
Main ClassHydrocarbons [FA11]
Sub Class-
PubChem CID5281517
HMDB IDHMDB0062763
InChIKeyJSNRRGGBADWTMC-NTCAYCPXSA-N  Show lipids differing only in stereochemistry/bond geometry
InChIInChI=1S/C15H24/c1-6-14(4)10-8-12-15(5)11-7-9-13(2)3/h6,9,12H,1,4,7-8,10-11H2,2-
3,5H3/b15-12+
SMILESC=CC(=C)CC/C=C(\C)/CC/C=C(\C)/C
MS SpectraView MoNA MS spectra     
StatusActive
CommentsPherobase Semiochemicals
Calculated physicochemical properties (?):
 Heavy Atoms15Rings0Aromatic Rings0Rotatable Bonds7
 van der Waals
Molecular Volume
257.50Topological Polar
Surface Area
0.00Hydrogen
Bond Donors
0Hydrogen
Bond Acceptors
0
 logP5.20Molar
Refractivity
70.99