| SpectraBase Compound ID | BNoN48w7NMl |
|---|---|
| InChI | InChI=1S/C7H12N2O2/c1-7-4-8(5-10)2-3-9(7)6-11/h5-7H,2-4H2,1H3 |
| InChIKey | BIVIDKSECBOVNI-UHFFFAOYSA-N |
| Mol Weight | 156.18 g/mol |
| Molecular Formula | C7H12N2O2 |
| Exact Mass | 156.089878 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | EyLCuS2MZM4 |
|---|---|
| Name | 2-Methyl-1,4-piperazinedicarboxaldehyde |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 156.089877632 u |
| Formula | C7H12N2O2 |
| InChI | InChI=1S/C7H12N2O2/c1-7-4-8(5-10)2-3-9(7)6-11/h5-7H,2-4H2,1H3 |
| InChIKey | BIVIDKSECBOVNI-UHFFFAOYSA-N |
| Molecular Weight | 156.185 g/mol |
| SMILES | C(=O)N1CC(N(CC1)C=O)C |
| Spectrum/Structure Validation Score (Raman) | 0.904349 |