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methyl (6S)-6-hydroxytetradeca-2,4-dienoate
SpectraBase Compound ID 1ouKDbmIvNC
InChI InChI=1S/C15H26O3/c1-3-4-5-6-7-8-11-14(16)12-9-10-13-15(17)18-2/h9-10,12-14,16H,3-8,11H2,1-2H3/t14-/m0/s1
InChIKey XESWXHYPUPZFMY-AWEZNQCLSA-N
Mol Weight 254.37 g/mol
Molecular Formula C15H26O3
Exact Mass 254.188195 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3dZJ2SfUPzu
Name methyl (6S)-6-hydroxytetradeca-2,4-dienoate
Appearance Colorless gum
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Formula C15H26O3
InChI InChI=1S/C15H26O3/c1-3-4-5-6-7-8-11-14(16)12-9-10-13-15(17)18-2/h9-10,12-14,16H,3-8,11H2,1-2H3/t14-/m0/s1
InChIKey XESWXHYPUPZFMY-AWEZNQCLSA-N
Instrument Name Finnigan MAT 95
Ionization Type EI
Literature Reference DOI 10.1021/np300004y
Molecular Weight 254.370 g/mol
Optical Rotation [a]20D = +24.3 (c = 0.07, MeOH)
Reported Formula C15H26O3
SMILES O[C@](C=CC=CC(OC)=O)(CCCCCCCC)[H]
SPLASH splash10-08fr-8900000000-2a45d4a7059b17b19d70
Source of Spectrum G4-75-SM25-2a
Wiley ID 1854786