| SpectraBase Compound ID | Iu5hNe4K4AQ |
|---|---|
| InChI | InChI=1S/C8H8Cl2O/c9-7-3-6(1-2-11)4-8(10)5-7/h3-5,11H,1-2H2 |
| InChIKey | HTPYSVJHLUKSRE-UHFFFAOYSA-N |
| Mol Weight | 191.06 g/mol |
| Molecular Formula | C8H8Cl2O |
| Exact Mass | 189.99522 g/mol |
Raman Spectrum
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 5nAdrB1a3vW |
|---|---|
| Name | Benzeneethanol, 3,5-dichloro- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 189.995220277 u |
| Formula | C8H8Cl2O |
| InChI | InChI=1S/C8H8Cl2O/c9-7-3-6(1-2-11)4-8(10)5-7/h3-5,11H,1-2H2 |
| InChIKey | HTPYSVJHLUKSRE-UHFFFAOYSA-N |
| SMILES | OCCC1=CC(=CC(=C1)Cl)Cl |
| Spectrum/Structure Validation Score (Raman) | 0.951477 |