| SpectraBase Compound ID | 5LUpRO1znZ2 |
|---|---|
| InChI | InChI=1S/C9H10ClNO/c1-7-2-4-8(5-3-7)11-9(12)6-10/h2-5H,6H2,1H3,(H,11,12) |
| InChIKey | CITIOELQTFSEGI-UHFFFAOYSA-N |
| Mol Weight | 183.64 g/mol |
| Molecular Formula | C9H10ClNO |
| Exact Mass | 183.045092 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | JkCT4VjhPEJ |
|---|---|
| Name | 2-Chloro-p-acetotoluidide |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 183.045091645 u |
| Formula | C9H10ClNO |
| InChI | InChI=1S/C9H10ClNO/c1-7-2-4-8(5-3-7)11-9(12)6-10/h2-5H,6H2,1H3,(H,11,12) |
| InChIKey | CITIOELQTFSEGI-UHFFFAOYSA-N |
| Molecular Weight | 183.638 g/mol |
| SMILES | N(C1=CC=C(C=C1)C)C(CCl)=O |
| Spectrum/Structure Validation Score (Raman) | 0.910896 |