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N-Acetylaspartic acid, 2tbdms derivative

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N-Acetylaspartic acid, 2tbdms derivative
SpectraBase Compound ID 4LaWzrIRFL5
InChI InChI=1S/C18H37NO5Si2/c1-13(20)19-14(16(22)24-26(10,11)18(5,6)7)12-15(21)23-25(8,9)17(2,3)4/h14H,12H2,1-11H3,(H,19,20)
InChIKey HCYCYJSKFSETNQ-UHFFFAOYSA-N
Mol Weight 403.7 g/mol
Molecular Formula C18H37NO5Si2
Exact Mass 403.221026 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KUI54YxxS0X
Name N-Acetylaspartic acid, 2tbdms derivative
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 403.221026360 u
Formula C18H37NO5Si2
InChI InChI=1S/C18H37NO5Si2/c1-13(20)19-14(16(22)24-26(10,11)18(5,6)7)12-15(21)23-25(8,9)17(2,3)4/h14H,12H2,1-11H3,(H,19,20)
InChIKey HCYCYJSKFSETNQ-UHFFFAOYSA-N
Molecular Weight 403.666 g/mol
SMILES C(O[Si](C)(C)C(C)(C)C)(=O)CC(NC(C)=O)C(=O)O[Si](C)(C)C(C)(C)C