Structure Database (LMSD)

Common Name
4,6-Dimethyl-2E,4E,6E-nonatriene
Systematic Name
4,6-Dimethyl-2E,4E,6E-nonatriene
Synonyms
LM ID
LMFA11000050
Formula
C11H18
Exact Mass
Calculate m/z
150.14085
Status
Active
Show lipids differing only in stereochemistry/bond geometry

Classification

Category
Main Class
Sub Class
Fatty Acyls [FA]
Hydrocarbons [FA11]

References

Comments
Pherobase Semiochemicals

String Representations

InChiKey (Click to copy)
TZSBLOZYIXZKCN-MROCENOWSA-N
InChi (Click to copy)
InChI=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+
SMILES (Click to copy)
C/C=C/C(/C)=C/C(/C)=C/CC

Other Databases

PubChem CID
56936063

Calculated Physicochemical Properties

Heavy Atoms 11
Rings 0
Aromatic Rings 0
Rotatable Bonds 3
Van der Waals Molecular Volume 190.94
Topological Polar Surface Area 0.00
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 0
logP 3.87
Molar Refractivity 52.62

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Created at
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Updated at
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