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l-Valinamide, N-(3-methyl-1-oxobutyl)-l-valyl-N-[10-(2-methoxy-2-oxoethyl)-12,12-dimethyl-1,9-bis(2-methylpropyl)-4,7-dioxo-2-[(trimethylsilyl)oxy]-6-[[(trimethylsilyl)oxy]methyl]-11-oxa-5,8-diaza-12-silatridec-1-yl]-, [1S-(1R*,2R*,6R*,9R*,10R*)]-
SpectraBase Compound ID 1eeOPY6XRz2
InChI InChI=1S/C44H89N5O10Si3/c1-27(2)21-32(47-43(54)41(31(9)10)49-44(55)40(30(7)8)48-37(50)23-29(5)6)35(58-61(15,16)17)24-38(51)45-34(26-57-60(12,13)14)42(53)46-33(22-28(3)4)36(25-39(52)56-11)59-62(18,19)20/h27-36,40-41H,21-26H2,1-20H3,(H,45,51)(H,46,53)(H,47,54)(H,48,50)(H,49,55)
InChIKey OMKOROOXWADNNN-UHFFFAOYSA-N
Mol Weight 932.5 g/mol
Molecular Formula C44H89N5O10Si3
Exact Mass 931.591724 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Lm4PV4mzJsh
Name L-Valinamide, N-(3-methyl-1-oxobutyl)-L-valyl-N-[10-(2-methoxy-2-oxoethyl)-12,12-dimethyl-1,9-bis(2-methylpropyl)-4,7-dioxo-2-[(trimethylsilyl)oxy]-6-[[(trimethylsilyl)oxy]methyl]-11-oxa-5,8-diaza-12-silatridec-1-yl]-, [1S-(1R*,2R*,6R*,9R*,10R*)]-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 931.591723681 u
Formula C44H89N5O10Si3
InChI InChI=1S/C44H89N5O10Si3/c1-27(2)21-32(47-43(54)41(31(9)10)49-44(55)40(30(7)8)48-37(50)23-29(5)6)35(58-61(15,16)17)24-38(51)45-34(26-57-60(12,13)14)42(53)46-33(22-28(3)4)36(25-39(52)56-11)59-62(18,19)20/h27-36,40-41H,21-26H2,1-20H3,(H,45,51)(H,46,53)(H,47,54)(H,48,50)(H,49,55)
InChIKey OMKOROOXWADNNN-UHFFFAOYSA-N
Molecular Weight 932.476 g/mol
SMILES COC(=O)CC(C(NC(=O)C(NC(=O)CC(C(NC(=O)C(C(C)C)NC(=O)C(C(C)C)NC(=O)CC(C)C)CC(C)C)O[Si](C)(C)C)CO[Si](C)(C)C)CC(C)C)O[Si](C)(C)C