| SpectraBase Compound ID | IIZHBRcEsgW |
|---|---|
| InChI | InChI=1S/C5H10N2O/c8-5-7-3-1-6-2-4-7/h5-6H,1-4H2 |
| InChIKey | MSSDTZLYNMFTKN-UHFFFAOYSA-N |
| Mol Weight | 114.15 g/mol |
| Molecular Formula | C5H10N2O |
| Exact Mass | 114.079313 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | FNq6BUNGqD9 |
|---|---|
| Name | 1-Piperazinecarboxaldehyde |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 114.079312949 u |
| Formula | C5H10N2O |
| InChI | InChI=1S/C5H10N2O/c8-5-7-3-1-6-2-4-7/h5-6H,1-4H2 |
| InChIKey | MSSDTZLYNMFTKN-UHFFFAOYSA-N |
| Molecular Weight | 114.148 g/mol |
| SMILES | N1CCN(CC1)C=O |
| Spectrum/Structure Validation Score (Raman) | 0.99806 |