| SpectraBase Compound ID | CjDo8qMn2B0 |
|---|---|
| InChI | InChI=1S/C10H10ClNO2/c1-7(13)12-9-4-2-8(3-5-9)10(14)6-11/h2-5H,6H2,1H3,(H,12,13) |
| InChIKey | VMMDOCYDNRLESP-UHFFFAOYSA-N |
| Mol Weight | 211.65 g/mol |
| Molecular Formula | C10H10ClNO2 |
| Exact Mass | 211.040006 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | 3cqNq4sBUAM |
|---|---|
| Name | 4'-(2-Chloroacetyl)acetanilide |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 211.040006264 u |
| Formula | C10H10ClNO2 |
| InChI | InChI=1S/C10H10ClNO2/c1-7(13)12-9-4-2-8(3-5-9)10(14)6-11/h2-5H,6H2,1H3,(H,12,13) |
| InChIKey | VMMDOCYDNRLESP-UHFFFAOYSA-N |
| Molecular Weight | 211.648 g/mol |
| SMILES | C(Cl)C(=O)C1=CC=C(NC(C)=O)C=C1 |
| Spectrum/Structure Validation Score (Raman) | 0.709195 |