| SpectraBase Compound ID | LH5v5AobYbu |
|---|---|
| InChI | InChI=1S/C6H10ClNO2/c1-4(9)5(7)6(10)8(2)3/h5H,1-3H3 |
| InChIKey | QJACRCAPQIYMIH-UHFFFAOYSA-N |
| Mol Weight | 163.6 g/mol |
| Molecular Formula | C6H10ClNO2 |
| Exact Mass | 163.040006 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | 4FuTLdG5tFN |
|---|---|
| Name | 2-Chloro-N,N-dimethylacetoacetamide |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 163.040006264 u |
| Formula | C6H10ClNO2 |
| InChI | InChI=1S/C6H10ClNO2/c1-4(9)5(7)6(10)8(2)3/h5H,1-3H3 |
| InChIKey | QJACRCAPQIYMIH-UHFFFAOYSA-N |
| Molecular Weight | 163.604 g/mol |
| SMILES | CC(C(C(N(C)C)=O)Cl)=O |
| Spectrum/Structure Validation Score (Raman) | 0.980799 |