| SpectraBase Compound ID | 3h4ZU9UOiEq |
|---|---|
| InChI | InChI=1S/C9H10ClNO/c10-6-8-3-1-7(2-4-8)5-9(11)12/h1-4H,5-6H2,(H2,11,12) |
| InChIKey | DDKYWWMTJDDHKO-UHFFFAOYSA-N |
| Mol Weight | 183.64 g/mol |
| Molecular Formula | C9H10ClNO |
| Exact Mass | 183.045092 g/mol |
Vapor Phase (Gas) Infrared Spectrum
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | HxOo6xl1BDY |
|---|---|
| Name | 4-Acetamidobenzyl chloride |
| 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/c10-6-8-3-1-7(2-4-8)5-9(11)12/h1-4H,5-6H2,(H2,11,12) |
| InChIKey | DDKYWWMTJDDHKO-UHFFFAOYSA-N |
| Molecular Weight | 183.638 g/mol |
| SMILES | C1=C(C=CC(=C1)CC(N)=O)CCl |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.819316 |