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[(1R,7R,8R,9R,9aS)-7,8,9-tribenzoxyquinolizidin-1-yl]oxy-tert-butyl-dimethyl-silane

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

[(1R,7R,8R,9R,9aS)-7,8,9-tribenzoxyquinolizidin-1-yl]oxy-tert-butyl-dimethyl-silane
SpectraBase Compound ID B4CmFMBHBrR
InChI InChI=1S/C36H49NO4Si/c1-36(2,3)42(4,5)41-31-22-15-23-37-24-32(38-25-28-16-9-6-10-17-28)34(39-26-29-18-11-7-12-19-29)35(33(31)37)40-27-30-20-13-8-14-21-30/h6-14,16-21,31-35H,15,22-27H2,1-5H3/t31-,32-,33-,34-,35-/m1/s1
InChIKey QNROAZLNWMVQOI-ZQPTVKGJSA-N
Mol Weight 587.9 g/mol
Molecular Formula C36H49NO4Si
Exact Mass 587.343086 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GAoDAhsctcG
Name [(1R,7R,8R,9R,9as)-7,8,9-Tribenzoxyquinolizidin-1-yl]oxy-tert-butyl-dimethyl-silane
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 587.343085593 u
Formula C36H49NO4Si
InChI InChI=1S/C36H49NO4Si/c1-36(2,3)42(4,5)41-31-22-15-23-37-24-32(38-25-28-16-9-6-10-17-28)34(39-26-29-18-11-7-12-19-29)35(33(31)37)40-27-30-20-13-8-14-21-30/h6-14,16-21,31-35H,15,22-27H2,1-5H3/t31-,32-,33-,34-,35-/m1/s1
InChIKey QNROAZLNWMVQOI-ZQPTVKGJSA-N
Molecular Weight 587.876 g/mol
SMILES [C@@]1([C@@]2(N(CCC[C@]2(O[Si](C(C)(C)C)(C)C)[H])C[C@]([C@]1(OCC=1C=CC=CC1)[H])(OCC1=CC=CC=C1)[H])[H])(OCC1=CC=CC=C1)[H]