| SpectraBase Compound ID | AJqqkvtwfw9 |
|---|---|
| InChI | InChI=1S/C9H8Cl2O/c10-6-8(11)9(12)7-4-2-1-3-5-7/h1-5,8H,6H2 |
| InChIKey | QLEVLWYKDVQOTD-UHFFFAOYSA-N |
| Mol Weight | 203.07 g/mol |
| Molecular Formula | C9H8Cl2O |
| Exact Mass | 201.99522 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 | HB6vfmcRuPV |
|---|---|
| Name | 2,3-bis(Chloranyl)-1-phenyl-propan-1-one |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 201.995220277 u |
| Formula | C9H8Cl2O |
| InChI | InChI=1S/C9H8Cl2O/c10-6-8(11)9(12)7-4-2-1-3-5-7/h1-5,8H,6H2 |
| InChIKey | QLEVLWYKDVQOTD-UHFFFAOYSA-N |
| Molecular Weight | 203.068 g/mol |
| SMILES | C(C(CCl)Cl)(=O)C=1C=CC=CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.832786 |