| SpectraBase Compound ID | BFBsrHrhrOY |
|---|---|
| InChI | InChI=1S/C7H13NO2/c1-7(2,3)5(9)4-6(8)10/h4H2,1-3H3,(H2,8,10) |
| InChIKey | KRVLBTHTMKIAGH-UHFFFAOYSA-N |
| Mol Weight | 143.19 g/mol |
| Molecular Formula | C7H13NO2 |
| Exact Mass | 143.094629 g/mol |
| SpectraBase Spectrum ID | 6Ny8RNncyL2 |
|---|---|
| Name | 4,4-Dimethyl-3-oxopentanamide |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 143.094628661 u |
| Formula | C7H13NO2 |
| InChI | InChI=1S/C7H13NO2/c1-7(2,3)5(9)4-6(8)10/h4H2,1-3H3,(H2,8,10) |
| InChIKey | KRVLBTHTMKIAGH-UHFFFAOYSA-N |
| Molecular Weight | 143.186 g/mol |
| SMILES | C(CC(C(C)(C)C)=O)(=O)N |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.916525 |