![3,7-Dimethyl-9-oxo-3,7-diazabicyclo[3.3.1]nonane-1,5-dicarboxylic acid, dimethyl ester](/api/spectrum/KyT8xgoI1DV/structure.png?h=300&w=458 "3,7-Dimethyl-9-oxo-3,7-diazabicyclo[3.3.1]nonane-1,5-dicarboxylic acid, dimethyl ester")
| SpectraBase Compound ID | L54nd4nGXKd |
|---|---|
| InChI | InChI=1S/C13H20N2O5/c1-14-5-12(10(17)19-3)7-15(2)8-13(6-14,9(12)16)11(18)20-4/h5-8H2,1-4H3 |
| InChIKey | RNZOKFYTJHZHQE-UHFFFAOYSA-N |
| Mol Weight | 284.31 g/mol |
| Molecular Formula | C13H20N2O5 |
| Exact Mass | 284.137222 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KyT8xgoI1DV |
|---|---|
| Name | 3,7-Dimethyl-9-oxo-3,7-diazabicyclo[3.3.1]nonane-1,5-dicarboxylic acid, dimethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 284.137221747 u |
| Formula | C13H20N2O5 |
| InChI | InChI=1S/C13H20N2O5/c1-14-5-12(10(17)19-3)7-15(2)8-13(6-14,9(12)16)11(18)20-4/h5-8H2,1-4H3 |
| InChIKey | RNZOKFYTJHZHQE-UHFFFAOYSA-N |
| SMILES | C1N(CC2(CN(CC1(C2=O)C(OC)=O)C)C(OC)=O)C |