![4-Keto-4-[2-[(4-keto-4-methoxy-butanoyl)amino]ethylamino]butyric acid methyl ester](/api/spectrum/AjR9ulBQxF1/structure.png?h=300&w=458 "4-Keto-4-[2-[(4-keto-4-methoxy-butanoyl)amino]ethylamino]butyric acid methyl ester")
| SpectraBase Compound ID | 8N4WQ8oNJ5R |
|---|---|
| InChI | InChI=1S/C12H20N2O6/c1-19-11(17)5-3-9(15)13-7-8-14-10(16)4-6-12(18)20-2/h3-8H2,1-2H3,(H,13,15)(H,14,16) |
| InChIKey | FZUCPKCDBZAWQQ-UHFFFAOYSA-N |
| Mol Weight | 288.3 g/mol |
| Molecular Formula | C12H20N2O6 |
| Exact Mass | 288.132136 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AjR9ulBQxF1 |
|---|---|
| Name | 4-Keto-4-[2-[(4-keto-4-methoxy-butanoyl)amino]ethylamino]butyric acid methyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 288.132136366 u |
| Formula | C12H20N2O6 |
| InChI | InChI=1S/C12H20N2O6/c1-19-11(17)5-3-9(15)13-7-8-14-10(16)4-6-12(18)20-2/h3-8H2,1-2H3,(H,13,15)(H,14,16) |
| InChIKey | FZUCPKCDBZAWQQ-UHFFFAOYSA-N |
| SMILES | C(=O)(NCCNC(=O)CCC(=O)OC)CCC(=O)OC |