| SpectraBase Compound ID | HvsNcQ31Ta |
|---|---|
| InChI | InChI=1S/C10H17NO2/c1-8(12)7-10(13)11-9-5-3-2-4-6-9/h9H,2-7H2,1H3,(H,11,13) |
| InChIKey | FLCPERRDPXWFDK-UHFFFAOYSA-N |
| Mol Weight | 183.25 g/mol |
| Molecular Formula | C10H17NO2 |
| Exact Mass | 183.125929 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | AOGda1CpGKr |
|---|---|
| Name | N-Cyclohexylacetoacetamide |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 183.125928789 u |
| Formula | C10H17NO2 |
| InChI | InChI=1S/C10H17NO2/c1-8(12)7-10(13)11-9-5-3-2-4-6-9/h9H,2-7H2,1H3,(H,11,13) |
| InChIKey | FLCPERRDPXWFDK-UHFFFAOYSA-N |
| Molecular Weight | 183.251 g/mol |
| SMILES | N(C1CCCCC1)C(CC(C)=O)=O |
| Spectrum/Structure Validation Score (Raman) | 0.877661 |