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type II F2-isoprostane, reduced methyl ester TMS derivative
SpectraBase Compound ID A6n1dORGeZD
InChI InChI=1S/C30H64O5Si3/c1-12-13-14-15-16-17-19-25(33-36(3,4)5)22-23-27-26(20-18-21-30(31)32-2)28(34-37(6,7)8)24-29(27)35-38(9,10)11/h25-29H,12-24H2,1-11H3/t25?,26-,27+,28+,29-/m1/s1
InChIKey NFMNKJLJMDBIOR-BAHBXDMESA-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 G68K4rs90Xv
Name type II F2-isoprostane, reduced methyl ester TMS derivative
Alternate Name(s) Methyl 13-{2-ethyl-3,5-bis[(trimethylsilyl)oxy]cyclopentyl}-11-[(trimethylsilyl)oxy]tridecanoate
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Formula C30H64O5Si3
InChI InChI=1S/C30H64O5Si3/c1-12-13-14-15-16-17-19-25(33-36(3,4)5)22-23-27-26(20-18-21-30(31)32-2)28(34-37(6,7)8)24-29(27)35-38(9,10)11/h25-29H,12-24H2,1-11H3/t25?,26-,27+,28+,29-/m1/s1
InChIKey NFMNKJLJMDBIOR-BAHBXDMESA-N
Molecular Weight 589.092 g/mol
SMILES [C@]1([C@]([C@@](CCCC(=O)OC)([C@](C1)(O[Si](C)(C)C)[H])[H])(CCC(O[Si](C)(C)C)CCCCCCCC)[H])(O[Si](C)(C)C)[H]
SPLASH splash10-014j-2491100000-0051e85f03a8dba4fc93
Source of Spectrum JA-7-490-0
Wiley ID 1409172