| SpectraBase Compound ID | 7axX6QMkwji |
|---|---|
| InChI | InChI=1S/C9H8Cl2O/c10-9(11)5-8(9)6-1-3-7(12)4-2-6/h1-4,8,12H,5H2 |
| InChIKey | JCHIUDLMOJNKRT-UHFFFAOYSA-N |
| Mol Weight | 203.07 g/mol |
| Molecular Formula | C9H8Cl2O |
| Exact Mass | 201.99522 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 427tVrFAZAM |
|---|---|
| Name | 4-(2,2-Dichlorocyclopropyl)phenol |
| 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/c10-9(11)5-8(9)6-1-3-7(12)4-2-6/h1-4,8,12H,5H2 |
| InChIKey | JCHIUDLMOJNKRT-UHFFFAOYSA-N |
| Molecular Weight | 203.068 g/mol |
| SMILES | C1(O)=CC=C(C=C1)C1CC1(Cl)Cl |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.912588 |