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(3S,5S)-2-[(E)-but-2-enyl]-5-[2-(1,3-dioxolan-2-yl)ethyl]-3-(1,3-dithian-2-yl)-6-trimethylsilyl-1-cyclohexanone
SpectraBase Compound ID 7vy8PosHZMk
InChI InChI=1S/C22H38O3S2Si/c1-5-6-8-17-18(22-26-13-7-14-27-22)15-16(9-10-19-24-11-12-25-19)21(20(17)23)28(2,3)4/h5-6,16-19,21-22H,7-15H2,1-4H3/b6-5+/t16-,17?,18-,21?/m0/s1
InChIKey CKCLLIGUYDXAPO-DAWNGBCWSA-N
Mol Weight 442.7 g/mol
Molecular Formula C22H38O3S2Si
Exact Mass 442.203164 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HoVuXWT0woZ
Name (3S,5S)-2-[(E)-but-2-enyl]-5-[2-(1,3-dioxolan-2-yl)ethyl]-3-(1,3-dithian-2-yl)-6-trimethylsilyl-1-cyclohexanone
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Formula C22H38O3S2Si
InChI InChI=1S/C22H38O3S2Si/c1-5-6-8-17-18(22-26-13-7-14-27-22)15-16(9-10-19-24-11-12-25-19)21(20(17)23)28(2,3)4/h5-6,16-19,21-22H,7-15H2,1-4H3/b6-5+/t16-,17?,18-,21?/m0/s1
InChIKey CKCLLIGUYDXAPO-DAWNGBCWSA-N
Molecular Weight 442.748 g/mol
SMILES C1(C([C@@](C2SCCCS2)(C[C@@](C1[Si](C)(C)C)(CCC1OCCO1)[H])[H])C\C=C\C)=O
SPLASH splash10-00xr-7901000000-86dc57adb1d2b9b53fef
Source of Spectrum QE-4-64-20
Synonyms (3S,5S)-2-[(E)-but-2-enyl]-5-[2-(1,3-dioxolan-2-yl)ethyl]-3-(1,3-dithian-2-yl)-6-trimethylsilyl-cyclohexan-1-one (3S,5S)-2-[(E)-but-2-enyl]-5-[2-(1,3-dioxolan-2-yl)ethyl]-3-(1,3-dithian-2-yl)-6-trimethylsilyl-cyclohexanone
Wiley ID 843413