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Tert-butyl (2S)-2-[(1S,3Z,5S)-6-{[tert-butyl(diphenyl)silyl]oxy}-1-hydroxy-1,5-dimethyl-4-(triphenylstannyl)-3-hexenyl]-1-pyrrolidinecarboxylate
SpectraBase Compound ID CqovZHfCEbT
InChI InChI=1S/C33H48NO4Si.3C6H5.Sn/c1-26(17-15-23-33(8,36)29-22-16-24-34(29)30(35)38-31(2,3)4)25-37-39(32(5,6)7,27-18-11-9-12-19-27)28-20-13-10-14-21-28;3*1-2-4-6-5-3-1;/h9-15,18-21,26,29,36H,16,22-25H2,1-8H3;3*1-5H;/t26-,29+,33+;;;;/m1..../s1
InChIKey BRLDWGILBDXSRD-KLELQJEWSA-N
Mol Weight 900.9 g/mol
Molecular Formula C51H63NO4SiSn
Exact Mass 901.354838 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KPvoAou3sN1
Name Tert-butyl (2S)-2-[(1S,3Z,5S)-6-{[tert-butyl(diphenyl)silyl]oxy}-1-hydroxy-1,5-dimethyl-4-(triphenylstannyl)-3-hexenyl]-1-pyrrolidinecarboxylate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 901.354838044 u
Formula C51H63NO4SiSn
InChI InChI=1S/C33H48NO4Si.3C6H5.Sn/c1-26(17-15-23-33(8,36)29-22-16-24-34(29)30(35)38-31(2,3)4)25-37-39(32(5,6)7,27-18-11-9-12-19-27)28-20-13-10-14-21-28;3*1-2-4-6-5-3-1;/h9-15,18-21,26,29,36H,16,22-25H2,1-8H3;3*1-5H;/t26-,29+,33+;;;;/m1..../s1
InChIKey BRLDWGILBDXSRD-KLELQJEWSA-N
Molecular Weight 900.864 g/mol
SMILES [C@]1(N(CCC1)C(=O)OC(C)(C)C)([C@@](C\C=C\([C@](CO[Si](C=1C=CC=CC1)(C=1C=CC=CC1)C(C)(C)C)(C)[H])[Sn](C=1C=CC=CC1)(C=1C=CC=CC1)C=1C=CC=CC1)(C)O)[H]