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(+)-(2Z,1'S,4S,5S)-4-METHYL-7-[(DIMETHYL-(PHENYL)-SILYL)-METHYL]-5-(1'-PHENYLETHOXY)-OCTA-2,7-DIEN-3-YL-BENZOATE
SpectraBase Compound ID 1qSoE52UQwC
InChI InChI=1S/C33H40O3Si/c1-7-31(36-33(34)29-19-13-9-14-20-29)26(3)32(35-27(4)28-17-11-8-12-18-28)23-25(2)24-37(5,6)30-21-15-10-16-22-30/h7-22,26-27,32H,2,23-24H2,1,3-6H3/b31-7-/t26-,27-,32-/m0/s1
InChIKey IWSONLQWVLJZDF-YWPMUSODSA-N
Mol Weight 512.8 g/mol
Molecular Formula C33H40O3Si
Exact Mass 512.274672 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GPqqE2tgu8T
Name (+)-(2Z,1'S,4S,5S)-4-METHYL-7-[(DIMETHYL-(PHENYL)-SILYL)-METHYL]-5-(1'-PHENYLETHOXY)-OCTA-2,7-DIEN-3-YL-BENZOATE
Compound Number 21
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C33H40O3Si
InChI InChI=1S/C33H40O3Si/c1-7-31(36-33(34)29-19-13-9-14-20-29)26(3)32(35-27(4)28-17-11-8-12-18-28)23-25(2)24-37(5,6)30-21-15-10-16-22-30/h7-22,26-27,32H,2,23-24H2,1,3-6H3/b31-7-/t26-,27-,32-/m0/s1
InChIKey IWSONLQWVLJZDF-YWPMUSODSA-N
Literature Reference Author M.TURKS,F.FONQUERNE,P.VOGEL
Literature Reference Citation ORG.LETTERS,6,1053(2004)
Literature Reference DOI 10.1021/ol0498646
Molecular Weight 512.764 g/mol
Sample ID 50208
Solvent CDCl3