Structure database (LMSD)

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LM IDLMFA07010493
Common NameMethyl 9Z-tetradecenoate
Systematic NameMethyl 9Z-tetradecenoate
SynonymsWE(1:0/14:1(9Z))
Exact Mass
240.2089 (neutral)    Calculate m/z:
FormulaC15H28O2
CategoryFatty Acyls [FA]
Main ClassFatty esters [FA07]
Sub ClassWax monoesters [FA0701]
Alternative ClassesUnsaturated fatty acids[FA0103]
PubChem CID5352674
CHEBI ID143579
CAYMAN ID10008581
InChIKeyRWIPSJUSVXDVPB-SREVYHEPSA-N  Show lipids differing only in stereochemistry/bond geometry
InChI
InChI=1S/C15H28O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15(16)17-2/h6-7H,3-5,8-14H2,1-2H3/b7-6-
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SMILES
O=C(CCCCCCC/C=C\CCCC)OC
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MS SpectraView MoNA MS spectra     
StatusActive
CommentsPherobase Semiochemicals
Calculated physicochemical properties (?):
 Heavy Atoms17Rings0Aromatic Rings0Rotatable Bonds12
 van der Waals
Molecular Volume
280.36Topological Polar
Surface Area
26.30Hydrogen
Bond Donors
0Hydrogen
Bond Acceptors
2
 logP4.64Molar
Refractivity
73.00