| SpectraBase Compound ID | 2RG6dHDySHz |
|---|---|
| InChI | InChI=1S/C9H17NO2/c1-9(2,3)8(12)10-6-4-5-7-11/h7H,4-6H2,1-3H3,(H,10,12) |
| InChIKey | KXGRJDXJSBBQBC-UHFFFAOYSA-N |
| Mol Weight | 171.24 g/mol |
| Molecular Formula | C9H17NO2 |
| Exact Mass | 171.125929 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 877l5IipBQh |
|---|---|
| Name | 2,2-Dimethyl-N-(4-oxobutyl)propanamide |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 171.125928789 u |
| Formula | C9H17NO2 |
| InChI | InChI=1S/C9H17NO2/c1-9(2,3)8(12)10-6-4-5-7-11/h7H,4-6H2,1-3H3,(H,10,12) |
| InChIKey | KXGRJDXJSBBQBC-UHFFFAOYSA-N |
| Molecular Weight | 171.240 g/mol |
| SMILES | C(C(C)(C)C)(=O)NCCCC=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.982362 |