| SpectraBase Compound ID | BhldUsbzDSI |
|---|---|
| InChI | InChI=1S/C11H12ClNO2/c1-2-15-8-7-11(14)13-10-5-3-9(12)4-6-10/h3-8H,2H2,1H3,(H,13,14) |
| InChIKey | WELRXSLQWKBZGF-UHFFFAOYSA-N |
| Mol Weight | 225.67 g/mol |
| Molecular Formula | C11H12ClNO2 |
| Exact Mass | 225.055656 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | 7F25ZWeyeHT |
|---|---|
| Name | 4'-Chloro-3-ethoxyacrylanilide |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 225.055656328 u |
| Formula | C11H12ClNO2 |
| InChI | InChI=1S/C11H12ClNO2/c1-2-15-8-7-11(14)13-10-5-3-9(12)4-6-10/h3-8H,2H2,1H3,(H,13,14) |
| InChIKey | WELRXSLQWKBZGF-UHFFFAOYSA-N |
| Molecular Weight | 225.675 g/mol |
| SMILES | N(C1=CC=C(C=C1)Cl)C(C=COCC)=O |
| Spectrum/Structure Validation Score (Raman) | 0.815006 |