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Ethyl 7-(tert-Butyldimethylsiloxy)-3,5-dihydroxy-8-(2-styryl-[1,3]dithian-2-yl)octanoate isomer
SpectraBase Compound ID G6G8EbRGHZY
InChI InChI=1S/C28H46O5S2Si/c1-7-32-26(31)20-24(30)18-23(29)19-25(33-36(5,6)27(2,3)4)21-28(34-16-11-17-35-28)15-14-22-12-9-8-10-13-22/h8-10,12-15,23-25,29-30H,7,11,16-21H2,1-6H3/b15-14+/t23?,24?,25-/m0/s1
InChIKey JVIHJSOMWSFZKU-GQHCRUNFSA-N
Mol Weight 554.9 g/mol
Molecular Formula C28H46O5S2Si
Exact Mass 554.255593 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 226ZdKuj3PH
Name Ethyl 7-(tert-Butyldimethylsiloxy)-3,5-dihydroxy-8-(2-styryl-[1,3]dithian-2-yl)octanoate isomer
Alternate Name(s) Ethyl 7-(tert-Butyldimethylsiloxy)-3,5-dihydroxy-8-(2-styryl-[1,3]dithian-2-yl)octanoateisomer
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Formula C28H46O5S2Si
InChI InChI=1S/C28H46O5S2Si/c1-7-32-26(31)20-24(30)18-23(29)19-25(33-36(5,6)27(2,3)4)21-28(34-16-11-17-35-28)15-14-22-12-9-8-10-13-22/h8-10,12-15,23-25,29-30H,7,11,16-21H2,1-6H3/b15-14+/t23?,24?,25-/m0/s1
InChIKey JVIHJSOMWSFZKU-GQHCRUNFSA-N
Molecular Weight 554.876 g/mol
SMILES OC(CC(C[C@](O[Si](C(C)(C)C)(C)C)(CC1(\C=C\c2ccccc2)SCCCS1)[H])O)CC(=O)OCC
SPLASH splash10-00or-2900010000-05fc894b12e433a4133d
Source of Spectrum KD-12-2841-21
Wiley ID 1634695