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(S)-2-[3-(tert-Butyldimethylsilyloxy)phenyl]-3-hydroxy-3-(2-trimethylsilyl-1-ethynyl)-1-cyclohexenylmethyl pivalate
SpectraBase Compound ID 5YhgQDhfPCa
InChI InChI=1S/C29H46O4Si2/c1-27(2,3)26(30)32-21-23-15-13-17-29(31,18-19-34(7,8)9)25(23)22-14-12-16-24(20-22)33-35(10,11)28(4,5)6/h12,14,16,20,31H,13,15,17,21H2,1-11H3/t29-/m1/s1
InChIKey PGXWFUFOADSTSL-GDLZYMKVSA-N
Mol Weight 514.9 g/mol
Molecular Formula C29H46O4Si2
Exact Mass 514.293463 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GRgIo1I29PC
Name (S)-2-[3-(tert-Butyldimethylsilyloxy)phenyl]-3-hydroxy-3-(2-trimethylsilyl-1-ethynyl)-1-cyclohexenylmethyl pivalate
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Formula C29H46O4Si2
InChI InChI=1S/C29H46O4Si2/c1-27(2,3)26(30)32-21-23-15-13-17-29(31,18-19-34(7,8)9)25(23)22-14-12-16-24(20-22)33-35(10,11)28(4,5)6/h12,14,16,20,31H,13,15,17,21H2,1-11H3/t29-/m1/s1
InChIKey PGXWFUFOADSTSL-GDLZYMKVSA-N
Molecular Weight 514.853 g/mol
SMILES O[C@@]1(C(c2cc(O[Si](C(C)(C)C)(C)C)ccc2)=C(COC(C(C)(C)C)=O)CCC1)C#C[Si](C)(C)C
SPLASH splash10-0a4i-0900300000-4a6b18ba20903b77af61
Source of Spectrum F-53-9162-9
Synonyms 2-[3-(tert-Butyldimethylsilyloxy)phenyl]-3-hydroxy-3-(2-trimethylsilyl-1-ethynyl)-1-cyclohexenylmethyl pivalate {(3S)-2-(3-{[tert-butyl(dimethyl)silyl]oxy}phenyl)-3-hydroxy-3-[(trimethylsilyl)ethynyl]-1-cyclohexen-1-yl}methyl pivalate
Wiley ID 802724