Structure Database (LMSD)

Common Name
Butylidenecyclohexane
Systematic Name
Butylidenecyclohexane
Synonyms
LM ID
LMFA11000658
Formula
C10H18
Exact Mass
Calculate m/z
138.14085
Status
Curated
Show lipids differing only in stereochemistry/bond geometry

Classification

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

References

Taxonomy Information

Curated from
NCBI taxonomy class
Reference
Nostoc sp. (#1180)
Cyanophyceae (#3028117)
Separation and identification of hydrocarbons and other volatile compounds from cultured blue-green alga Nostoc sp. by gas chromatography-mass spectrometry using serially coupled capillary columns with consecutive nonpolar and semipolar stationary phases.,
J Chromatogr A, 1999
Pubmed ID: 10596980

String Representations

InChiKey (Click to copy)
DVJPAIYXIZTKPM-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C10H18/c1-2-3-7-10-8-5-4-6-9-10/h7H,2-6,8-9H2,1H3
SMILES (Click to copy)
C1CCC/C(=C\CCC)/C1

Other Databases

PubChem CID
549155

Calculated Physicochemical Properties

Heavy Atoms 10
Rings 1
Aromatic Rings 0
Rotatable Bonds 2
Van der Waals Molecular Volume 166.56
Topological Polar Surface Area 0.00
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 0
logP 3.68
Molar Refractivity 46.08

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Updated at
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