GlcNAca/b1-3Xyla-4Galb1-3GalNAca1-4(NeuAc?1-2NeuGc4Mea1-3)GalNAcb1-4(EtnP-6)GlcNAcb1-3Manb1-4Glcb1-1Cer
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Structural Information
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Methyl-10,12-Epidioxy-13-Hydroperoxy-8,15-Octadecadienoate
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Formula
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C19H32O6
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Exact Mass
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356.219888756
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Average Mass
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356.45378
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SMILES
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C(O1)(CC(C=CCCCCCCC(=O)OC)O1)C(OO)CC=CCC
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Physicochemical Information
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Spectral Information
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Mass Spectra
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GC-EI-MS(after reduction(PH3P) and TMS-derivatization)
Neff_WE et al.: m/e=307[M-CH3- HOTMS]; 241[M-171]; 171[SMTO=CHCH2CH=CHCH2CH3], GC-EI-MS(after reduction, hydrogenation, and tms-derivatization)
Neff_WE et al.
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UV Spectra
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IR Spectra
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OOH group: 3660-3150cm-1[bonded], 3520cm-1[free]; OLEFINIC PROTONS: 3020-3002cm-1; isolated trans unsaturation: 960cm-1
Neff_WE et al.
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NMR Spectra
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1H-NMR(105): C17[terminal methyl group attached ton the vinyl group]: 1.78ppm
Neff_WE et al.
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Other Spectra
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Chromatograms
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