| SpectraBase Compound ID | ItjkdhmaBgx |
|---|---|
| InChI | InChI=1S/C7H15NO/c1-6(9)7(2,3)5-8-4/h8H,5H2,1-4H3 |
| InChIKey | QPKSAEVZZQMSER-UHFFFAOYSA-N |
| Mol Weight | 129.2 g/mol |
| Molecular Formula | C7H15NO |
| Exact Mass | 129.115364 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | DJ1QdZTb6j9 |
|---|---|
| Name | 3,3-Dimethyl-4-methylamino-butan-2-one |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 129.115364106 u |
| Formula | C7H15NO |
| InChI | InChI=1S/C7H15NO/c1-6(9)7(2,3)5-8-4/h8H,5H2,1-4H3 |
| InChIKey | QPKSAEVZZQMSER-UHFFFAOYSA-N |
| Molecular Weight | 129.203 g/mol |
| SMILES | CC(C(CNC)(C)C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.812744 |