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tert-butyl (3S,4S)-3,4-bis[2-[(3S,4S)-3,4-bis[[tert-butyl(dimethyl)silyl]oxy]pyrrolidin-1-yl]-2-oxo-ethoxy]pyrrolidine-1-carboxylate
SpectraBase Compound ID BZjdtGREEGw
InChI InChI=1S/C45H91N3O10Si4/c1-41(2,3)54-40(51)48-24-32(52-30-38(49)46-26-34(55-59(16,17)42(4,5)6)35(27-46)56-60(18,19)43(7,8)9)33(25-48)53-31-39(50)47-28-36(57-61(20,21)44(10,11)12)37(29-47)58-62(22,23)45(13,14)15/h32-37H,24-31H2,1-23H3/t32-,33-,34-,35-,36-,37-/m0/s1
InChIKey WDTRXSDSVFJNDB-DUGSHLAESA-N
Mol Weight 946.6 g/mol
Molecular Formula C45H91N3O10Si4
Exact Mass 945.578152 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 99P53LgBG7R
Name tert-butyl (3S,4S)-3,4-bis[2-[(3S,4S)-3,4-bis[[tert-butyl(dimethyl)silyl]oxy]pyrrolidin-1-yl]-2-oxo-ethoxy]pyrrolidine-1-carboxylate
Appearance Oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C45H91N3O10Si4
InChI InChI=1S/C45H91N3O10Si4/c1-41(2,3)54-40(51)48-24-32(52-30-38(49)46-26-34(55-59(16,17)42(4,5)6)35(27-46)56-60(18,19)43(7,8)9)33(25-48)53-31-39(50)47-28-36(57-61(20,21)44(10,11)12)37(29-47)58-62(22,23)45(13,14)15/h32-37H,24-31H2,1-23H3/t32-,33-,34-,35-,36-,37-/m0/s1
InChIKey WDTRXSDSVFJNDB-DUGSHLAESA-N
Instrument Name QMD 1000 Carlo Erba
Ionization Type EI
Literature Reference DOI 10.3762/bjoc.8.107
Molecular Weight 946.574 g/mol
Optical Rotation [a]D22 = -2.5 (c = 0.585, CH2Cl2)
SMILES C(O[C@@]1([C@@](OCC(N2C[C@@]([C@](C2)(O[Si](C(C)(C)C)(C)C)[H])(O[Si](C(C)(C)C)(C)C)[H])=O)(CN(C(OC(C)(C)C)=O)C1)[H])[H])C(N1C[C@@]([C@](C1)(O[Si](C(C)(C)C)(C)C)[H])(O[Si](C(C)(C)C)(C)C)[H])=O
SPLASH splash10-056r-4910000000-6b8a46526af86bddafe0
Source of Spectrum BJO-8-SM9-10
Thin-Layer Chromatography Rf = 0.33 (CH2Cl2/MeOH = 100:5)
Wiley ID 1864879