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(2R,3R,4R)-2-[N-(benzxoxycarbonyl)amino]-4-(benzoyloxy)-3-[(tert-butyldimethylsilyl)oxy]-5-hexen-1-ol
SpectraBase Compound ID 4PGMPoA8h1b
InChI InChI=1S/C27H37NO6Si/c1-7-23(33-25(30)21-16-12-9-13-17-21)24(34-35(5,6)27(2,3)4)22(18-29)28-26(31)32-19-20-14-10-8-11-15-20/h7-17,22-24,29H,1,18-19H2,2-6H3,(H,28,31)/t22-,23-,24-/m1/s1
InChIKey QIKHWNQZKQPFFM-WXFUMESZSA-N
Mol Weight 499.7 g/mol
Molecular Formula C27H37NO6Si
Exact Mass 499.239014 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 45Liejk3zh9
Name (2R,3R,4R)-2-[N-(Benzxoxycarbonyl)amino]-4-(benzoyloxy)-3-[(tert-butyldimethylsilyl)oxy]-5-hexen-1-ol
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 499.239014444 u
Formula C27H37NO6Si
InChI InChI=1S/C27H37NO6Si/c1-7-23(33-25(30)21-16-12-9-13-17-21)24(34-35(5,6)27(2,3)4)22(18-29)28-26(31)32-19-20-14-10-8-11-15-20/h7-17,22-24,29H,1,18-19H2,2-6H3,(H,28,31)/t22-,23-,24-/m1/s1
InChIKey QIKHWNQZKQPFFM-WXFUMESZSA-N
Molecular Weight 499.679 g/mol
SMILES [C@](O[Si](C(C)(C)C)(C)C)([C@](NC(=O)OCC=1C=CC=CC1)(CO)[H])([C@](OC(=O)C1=CC=CC=C1)(C=C)[H])[H]