Structure database (LMSD)

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LM IDLMFA11000047
Common Name4,8,12-Trimethyl-1,3E,7E,11-tridecatetraene
Systematic Name4,8,12-Trimethyl-1,3E,7E,11-tridecatetraene
Synonyms-
Exact Mass
220.2191 (neutral)    Calculate m/z:
FormulaC16H28
CategoryFatty Acyls [FA]
Main ClassHydrocarbons [FA11]
Sub Class-
PubChem CID20200974
InChIKeyXVIPCWLIFRBCRP-RNPYNJAESA-N  Show lipids differing only in stereochemistry/bond geometry
InChIInChI=1S/C16H28/c1-6-9-15(4)12-8-13-16(5)11-7-10-14(2)3/h9-10,13H,6-8,11-12H2,1-
5H3/b15-9+,16-13+
SMILESCC/C=C(\C)/CC/C=C(\C)/CC/C=C(\C)/C
StatusActive
CommentsPherobase Semiochemicals
Calculated physicochemical properties (?):
 Heavy Atoms16Rings0Aromatic Rings0Rotatable Bonds7
 van der Waals
Molecular Volume
277.44Topological Polar
Surface Area
0.00Hydrogen
Bond Donors
0Hydrogen
Bond Acceptors
0
 logP5.82Molar
Refractivity
75.70