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(1S,2S,8aS)-1,2-bis[[tert-butyl(diphenyl)silyl]oxy]-2,3,5,6,8,8a-hexahydro-1H-indolizin-7-one

View entire compound with spectra: 1 NMR, and 1 MS (GC)

(1S,2S,8aS)-1,2-bis[[tert-butyl(diphenyl)silyl]oxy]-2,3,5,6,8,8a-hexahydro-1H-indolizin-7-one
SpectraBase Compound ID 2gaQSX4H5hA
InChI InChI=1S/C40H49NO3Si2/c1-39(2,3)45(32-19-11-7-12-20-32,33-21-13-8-14-22-33)43-37-30-41-28-27-31(42)29-36(41)38(37)44-46(40(4,5)6,34-23-15-9-16-24-34)35-25-17-10-18-26-35/h7-26,36-38H,27-30H2,1-6H3/t36-,37-,38-/m0/s1
InChIKey IVPYGVQBKJSXEB-QXUSSCGESA-N
Mol Weight 648.0 g/mol
Molecular Formula C40H49NO3Si2
Exact Mass 647.325098 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2uZHP044w1S
Name (1S,2S,8as)-1,2-bis[[Tert-butyl(diphenyl)silyl]oxy]-2,3,5,6,8,8A-hexahydro-1H-indolizin-7-one
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 647.325097509 u
Formula C40H49NO3Si2
InChI InChI=1S/C40H49NO3Si2/c1-39(2,3)45(32-19-11-7-12-20-32,33-21-13-8-14-22-33)43-37-30-41-28-27-31(42)29-36(41)38(37)44-46(40(4,5)6,34-23-15-9-16-24-34)35-25-17-10-18-26-35/h7-26,36-38H,27-30H2,1-6H3/t36-,37-,38-/m0/s1
InChIKey IVPYGVQBKJSXEB-QXUSSCGESA-N
Molecular Weight 648.006 g/mol
SMILES [C@@]1([C@@](O[Si](C(C)(C)C)(C2=CC=CC=C2)C2=CC=CC=C2)(CN2[C@]1(CC(CC2)=O)[H])[H])(O[Si](C(C)(C)C)(C1=CC=CC=C1)C=1C=CC=CC1)[H]