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(1S,2S,5S)-2-((S)-2-(Tert-butyldiphenylsiloxy)-1-hydroxyethyl)-8-oxabicyclo[3.2.1]oct-6-en-3-one

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(1S,2S,5S)-2-((S)-2-(Tert-butyldiphenylsiloxy)-1-hydroxyethyl)-8-oxabicyclo[3.2.1]oct-6-en-3-one
SpectraBase Compound ID 8g4dc1wPYQh
InChI InChI=1S/C25H30O4Si/c1-25(2,3)30(19-10-6-4-7-11-19,20-12-8-5-9-13-20)28-17-22(27)24-21(26)16-18-14-15-23(24)29-18/h4-15,18,22-24,27H,16-17H2,1-3H3/t18-,22-,23+,24+/m1/s1
InChIKey NGIUHIPMCBVTIQ-LKDDOFHYSA-N
Mol Weight 422.6 g/mol
Molecular Formula C25H30O4Si
Exact Mass 422.191336 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 60HuYhOstcf
Name (1S,2S,5S)-2-((S)-2-(Tert-butyldiphenylsiloxy)-1-hydroxyethyl)-8-oxabicyclo[3.2.1]oct-6-en-3-one
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 422.191335977 u
Formula C25H30O4Si
InChI InChI=1S/C25H30O4Si/c1-25(2,3)30(19-10-6-4-7-11-19,20-12-8-5-9-13-20)28-17-22(27)24-21(26)16-18-14-15-23(24)29-18/h4-15,18,22-24,27H,16-17H2,1-3H3/t18-,22-,23+,24+/m1/s1
InChIKey NGIUHIPMCBVTIQ-LKDDOFHYSA-N
Molecular Weight 422.596 g/mol
SMILES C1([Si](OC[C@]([C@@]2(C(C[C@@]3(O[C@]2(C=C3)[H])[H])=O)[H])(O)[H])(C=2C=CC=CC2)C(C)(C)C)=CC=CC=C1