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(Z,4R)-6-[tert-butyl(diphenyl)silyl]oxy-2-ethyl-4-methyl-2-hexenoic acid ethyl ester
SpectraBase Compound ID GHwHorKnj2e
InChI InChI=1S/C27H38O3Si/c1-7-23(26(28)29-8-2)21-22(3)19-20-30-31(27(4,5)6,24-15-11-9-12-16-24)25-17-13-10-14-18-25/h9-18,21-22H,7-8,19-20H2,1-6H3/b23-21-/t22-/m1/s1
InChIKey OYAXTHJWVBUIGS-RKKARLDVSA-N
Mol Weight 438.7 g/mol
Molecular Formula C27H38O3Si
Exact Mass 438.259022 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DgZe3Ko1LDN
Name (Z,4R)-6-[Tert-butyl(diphenyl)silyl]oxy-2-ethyl-4-methyl-2-hexenoic acid ethyl ester
Comments Computed using HOSE algorithm
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Exact Mass 438.259021616 u
Formula C27H38O3Si
InChI InChI=1S/C27H38O3Si/c1-7-23(26(28)29-8-2)21-22(3)19-20-30-31(27(4,5)6,24-15-11-9-12-16-24)25-17-13-10-14-18-25/h9-18,21-22H,7-8,19-20H2,1-6H3/b23-21-/t22-/m1/s1
InChIKey OYAXTHJWVBUIGS-RKKARLDVSA-N
Molecular Weight 438.683 g/mol
SMILES C([Si](C=1C=CC=CC1)(C1=CC=CC=C1)OCC[C@](\C=C/(C(=O)OCC)CC)(C)[H])(C)(C)C