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(3R)-1-[(1R)-2-[tert-butyl(diphenyl)silyl]oxy-1-phenyl-ethyl]-4,4-diethoxy-piperidin-3-amine
SpectraBase Compound ID BJG05cGPNCN
InChI InChI=1S/C33H46N2O3Si/c1-6-36-33(37-7-2)23-24-35(25-31(33)34)30(27-17-11-8-12-18-27)26-38-39(32(3,4)5,28-19-13-9-14-20-28)29-21-15-10-16-22-29/h8-22,30-31H,6-7,23-26,34H2,1-5H3/t30-,31+/m0/s1
InChIKey BCJFJPZORFVXCQ-IOWSJCHKSA-N
Mol Weight 546.8 g/mol
Molecular Formula C33H46N2O3Si
Exact Mass 546.32777 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HmKSn83wEyR
Name (3R)-1-[(1R)-2-[Tert-butyl(diphenyl)silyl]oxy-1-phenyl-ethyl]-4,4-diethoxy-piperidin-3-amine
Comments Computed using HOSE algorithm
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Exact Mass 546.327769881 u
Formula C33H46N2O3Si
InChI InChI=1S/C33H46N2O3Si/c1-6-36-33(37-7-2)23-24-35(25-31(33)34)30(27-17-11-8-12-18-27)26-38-39(32(3,4)5,28-19-13-9-14-20-28)29-21-15-10-16-22-29/h8-22,30-31H,6-7,23-26,34H2,1-5H3/t30-,31+/m0/s1
InChIKey BCJFJPZORFVXCQ-IOWSJCHKSA-N
Molecular Weight 546.827 g/mol
SMILES C1N(CCC([C@@]1(N)[H])(OCC)OCC)[C@@](CO[Si](C(C)(C)C)(C=1C=CC=CC1)C=1C=CC=CC1)(C1=CC=CC=C1)[H]