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type I F2-isoprostane, reduced methyl ester TMS derivative
SpectraBase Compound ID J1VVMnOgFj
InChI InChI=1S/C30H64O5Si3/c1-12-13-14-15-16-17-20-26-27(29(35-38(9,10)11)24-28(26)34-37(6,7)8)23-22-25(33-36(3,4)5)19-18-21-30(31)32-2/h25-29H,12-24H2,1-11H3/t25-,26+,27-,28-,29+/m1/s1
InChIKey LQIWLLVKOWGKAQ-FOECPVOOSA-N
Mol Weight 589.1 g/mol
Molecular Formula C30H64O5Si3
Exact Mass 588.406155 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8x8luETjAN4
Name type I F2-isoprostane, reduced methyl ester TMS derivative
Alternate Name(s) (R)-7-((1R,2S,3R,5S)-2-Octyl-3,5-bis-trimethylsilanyloxy-cyclopentyl)-5-trimethylsilanyloxy-heptanoic acid methyl ester Methyl 10-(3,5-bis[(trimethylsilyl)oxy]-2-{3-[(trimethylsilyl)oxy]pentyl}cyclopentyl)decanoate
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Formula C30H64O5Si3
InChI InChI=1S/C30H64O5Si3/c1-12-13-14-15-16-17-20-26-27(29(35-38(9,10)11)24-28(26)34-37(6,7)8)23-22-25(33-36(3,4)5)19-18-21-30(31)32-2/h25-29H,12-24H2,1-11H3/t25-,26+,27-,28-,29+/m1/s1
InChIKey LQIWLLVKOWGKAQ-FOECPVOOSA-N
Molecular Weight 589.092 g/mol
SMILES [C@@]1([C@@]([C@](CCCCCCCC)([C@@](C1)(O[Si](C)(C)C)[H])[H])(CC[C@](O[Si](C)(C)C)(CCCC(=O)OC)[H])[H])(O[Si](C)(C)C)[H]
SPLASH splash10-0gbj-1294300000-96cd3ef8818ba036e043
Source of Spectrum JA-7-490-0
Wiley ID 1409173