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L-Aspartic acid, N-ethoxycarbonyl-, C(1)-methyl ester, C(4)-ethyl ester
SpectraBase Compound ID 19Yv1AAdhEB
InChI InChI=1S/C10H17NO6/c1-4-16-8(12)6-7(9(13)15-3)11-10(14)17-5-2/h7H,4-6H2,1-3H3,(H,11,14)
InChIKey MHUZFGOJPPXHDM-UHFFFAOYSA-N
Mol Weight 247.25 g/mol
Molecular Formula C10H17NO6
Exact Mass 247.105587 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1KnRzjJycSF
Name L-Aspartic acid, N-ethoxycarbonyl-, C(1)-methyl ester, C(4)-ethyl ester
Comments Computed using HOSE algorithm
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Exact Mass 247.105587265 u
Formula C10H17NO6
InChI InChI=1S/C10H17NO6/c1-4-16-8(12)6-7(9(13)15-3)11-10(14)17-5-2/h7H,4-6H2,1-3H3,(H,11,14)
InChIKey MHUZFGOJPPXHDM-UHFFFAOYSA-N
Molecular Weight 247.247 g/mol
SMILES C(C(C(OC)=O)NC(OCC)=O)C(OCC)=O