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(1R*,2R*,5S*,E)-2,5-Bis(p-chlorobenzyl)-2-(2-triethylsilylethenyl)-1-cyclopentanol
SpectraBase Compound ID 3oFPtCJSKNL
InChI InChI=1S/C27H36Cl2OSi/c1-4-31(5-2,6-3)18-17-27(20-22-9-13-25(29)14-10-22)16-15-23(26(27)30)19-21-7-11-24(28)12-8-21/h7-14,17-18,23,26,30H,4-6,15-16,19-20H2,1-3H3/b18-17+/t23-,26+,27-/m0/s1
InChIKey MHADPRBUKATFKR-IAIORHCUSA-N
Mol Weight 475.6 g/mol
Molecular Formula C27H36Cl2OSi
Exact Mass 474.191248 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GGnPaMj9lUF
Name (1R*,2R*,5S*,E)-2,5-Bis(p-chlorobenzyl)-2-(2-triethylsilylethenyl)-1-cyclopentanol
Alternate Name(s) (1R,2R,5S)-2,5-bis(4-chlorobenzyl)-2-[(E)-2-(triethylsilyl)ethenyl]cyclopentanol
Comments Less than 3 mono-isotopic peaks
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Formula C27H36Cl2OSi
InChI InChI=1S/C27H36Cl2OSi/c1-4-31(5-2,6-3)18-17-27(20-22-9-13-25(29)14-10-22)16-15-23(26(27)30)19-21-7-11-24(28)12-8-21/h7-14,17-18,23,26,30H,4-6,15-16,19-20H2,1-3H3/b18-17+/t23-,26+,27-/m0/s1
InChIKey MHADPRBUKATFKR-IAIORHCUSA-N
Molecular Weight 475.575 g/mol
SMILES O[C@]1([C@@](\C=C\[Si](CC)(CC)CC)(Cc2ccc(cc2)Cl)CC[C@]1(Cc1ccc(cc1)Cl)[H])[H]
SPLASH splash10-0udi-0900500000-1e09311a89322b05231a
Source of Spectrum CV-2004-1311-0
Wiley ID 1611511