| SpectraBase Compound ID | AH6sBhnmKb |
|---|---|
| InChI | InChI=1S/C7H13NO4.Cl/c1-3-11-6(9)5(8)7(10)12-4-2;/h5H,3-4,8H2,1-2H3; |
| InChIKey | KKJCIKFBNJPSKM-UHFFFAOYSA-N |
| Mol Weight | 210.64 g/mol |
| Molecular Formula | C7H13ClNO4 |
| Exact Mass | 210.053311 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | 5uJuEu7IPSK |
|---|---|
| Name | Diethyl aminomalonate hydrochloride |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 210.053310599 u |
| Formula | C7H13ClNO4 |
| InChI | InChI=1S/C7H13NO4.Cl/c1-3-11-6(9)5(8)7(10)12-4-2;/h5H,3-4,8H2,1-2H3; |
| InChIKey | KKJCIKFBNJPSKM-UHFFFAOYSA-N |
| Molecular Weight | 210.637 g/mol |
| Nominal Mass | 210 u |
| SMILES | C(N)(C(=O)OCC)C(=O)OCC.[Cl] |
| Spectrum/Structure Validation Score (Raman) | 0.889864 |