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N-Acetylaspartylglutamic acid, tris(trimethylsilyl) ester
SpectraBase Compound ID 3xyp6TcQjRu
InChI InChI=1S/C20H40N2O8Si3/c1-14(23)21-16(13-18(25)29-32(5,6)7)19(26)22-15(20(27)30-33(8,9)10)11-12-17(24)28-31(2,3)4/h15-16H,11-13H2,1-10H3,(H,21,23)(H,22,26)
InChIKey AXTJSBBPEHHGTC-UHFFFAOYSA-N
Mol Weight 520.8 g/mol
Molecular Formula C20H40N2O8Si3
Exact Mass 520.209246 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GR16Stj1Ebd
Name N-Acetylaspartylglutamic acid, tris(trimethylsilyl) ester
Comments Computed using HOSE algorithm
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Exact Mass 520.209245853 u
Formula C20H40N2O8Si3
InChI InChI=1S/C20H40N2O8Si3/c1-14(23)21-16(13-18(25)29-32(5,6)7)19(26)22-15(20(27)30-33(8,9)10)11-12-17(24)28-31(2,3)4/h15-16H,11-13H2,1-10H3,(H,21,23)(H,22,26)
InChIKey AXTJSBBPEHHGTC-UHFFFAOYSA-N
Molecular Weight 520.801 g/mol
SMILES C(C(NC(C(NC(=O)C)CC(=O)O[Si](C)(C)C)=O)CCC(=O)O[Si](C)(C)C)(=O)O[Si](C)(C)C