![{[(hexahydro-2-oxo-1H-azepin-3-yl)amino]methylene}malonic acid, diethyl ester](/api/spectrum/6z5OJt65Nf7/structure.png?h=300&w=458 "{[(hexahydro-2-oxo-1H-azepin-3-yl)amino]methylene}malonic acid, diethyl ester")
| SpectraBase Compound ID | IUTMbnaPyWh |
|---|---|
| InChI | InChI=1S/C14H22N2O5/c1-3-20-13(18)10(14(19)21-4-2)9-16-11-7-5-6-8-15-12(11)17/h9,11,16H,3-8H2,1-2H3,(H,15,17) |
| InChIKey | LDJNYHBJXIGZFT-UHFFFAOYSA-N |
| Mol Weight | 298.34 g/mol |
| Molecular Formula | C14H22N2O5 |
| Exact Mass | 298.152872 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6z5OJt65Nf7 |
|---|---|
| Name | {[(hexahydro-2-oxo-1H-azepin-3-yl)amino]methylene}malonic acid, diethyl ester |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C14H22N2O5 |
| InChI | InChI=1S/C14H22N2O5/c1-3-20-13(18)10(14(19)21-4-2)9-16-11-7-5-6-8-15-12(11)17/h9,11,16H,3-8H2,1-2H3,(H,15,17) |
| InChIKey | LDJNYHBJXIGZFT-UHFFFAOYSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 55770M |
| Solvent | CDCl3 |