| SpectraBase Compound ID | 3sRQJzbDdD3 |
|---|---|
| InChI | InChI=1S/C11H16N2O5/c1-3-18-7(14)5-4-6(2)8-9(15)12-11(17)13-10(8)16/h6,8H,3-5H2,1-2H3,(H2,12,13,15,16,17) |
| InChIKey | VXJMTLREBAPIBL-UHFFFAOYSA-N |
| Mol Weight | 256.26 g/mol |
| Molecular Formula | C11H16N2O5 |
| Exact Mass | 256.105922 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JtbFaj4LMRv |
|---|---|
| Name | Hexahydro-gamma-methyl-2,4,6-trioxo-5-pyrimidinebutyric acid, ethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 256.105921618 u |
| Formula | C11H16N2O5 |
| InChI | InChI=1S/C11H16N2O5/c1-3-18-7(14)5-4-6(2)8-9(15)12-11(17)13-10(8)16/h6,8H,3-5H2,1-2H3,(H2,12,13,15,16,17) |
| InChIKey | VXJMTLREBAPIBL-UHFFFAOYSA-N |
| SMILES | N1C(NC(C(C1=O)C(C)CCC(=O)OCC)=O)=O |