| SpectraBase Compound ID | 41YDo4et2ke |
|---|---|
| InChI | InChI=1S/C9H9ClO2/c10-8-3-1-7(2-4-8)9(12)5-6-11/h1-4,11H,5-6H2 |
| InChIKey | FNBBFEVBONZHRF-UHFFFAOYSA-N |
| Mol Weight | 184.62 g/mol |
| Molecular Formula | C9H9ClO2 |
| Exact Mass | 184.029107 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 | 6n8dtsCTtMl |
|---|---|
| Name | 1-(4-Chlorophenyl)-3-hydroxy-1-propanone |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 184.029107228 u |
| Formula | C9H9ClO2 |
| InChI | InChI=1S/C9H9ClO2/c10-8-3-1-7(2-4-8)9(12)5-6-11/h1-4,11H,5-6H2 |
| InChIKey | FNBBFEVBONZHRF-UHFFFAOYSA-N |
| Molecular Weight | 184.622 g/mol |
| SMILES | C(C=1C=CC(=CC1)Cl)(=O)CCO |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.961141 |