| SpectraBase Compound ID | KRTuiexTmO0 |
|---|---|
| InChI | InChI=1S/C6H12N2/c1-3-8(4-2)6-5-7/h3-4,6H2,1-2H3 |
| InChIKey | LVPZSMIBSMMLPI-UHFFFAOYSA-N |
| Mol Weight | 112.18 g/mol |
| Molecular Formula | C6H12N2 |
| Exact Mass | 112.100048 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | 74qiCRKGGTP |
|---|---|
| Name | (Diethylamino)acetonitrile |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 112.100048394 u |
| Formula | C6H12N2 |
| InChI | InChI=1S/C6H12N2/c1-3-8(4-2)6-5-7/h3-4,6H2,1-2H3 |
| InChIKey | LVPZSMIBSMMLPI-UHFFFAOYSA-N |
| Molecular Weight | 112.176 g/mol |
| SMILES | CCN(CC#N)CC |
| Spectrum/Structure Validation Score (Raman) | 0.982851 |