| SpectraBase Compound ID | L6hxSzGUkkv |
|---|---|
| InChI | InChI=1S/C15H12Cl2O2/c1-9-5-10(2)7-12(6-9)19-15(18)13-4-3-11(16)8-14(13)17/h3-8H,1-2H3 |
| InChIKey | ZPUYTAOTVOKVSZ-UHFFFAOYSA-N |
| Mol Weight | 295.17 g/mol |
| Molecular Formula | C15H12Cl2O2 |
| Exact Mass | 294.021435 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | JOAtFkodLH8 |
|---|---|
| Name | 3,5-Xylenol, 2,4-dichlorobenzoate |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 294.021435024 u |
| Formula | C15H12Cl2O2 |
| InChI | InChI=1S/C15H12Cl2O2/c1-9-5-10(2)7-12(6-9)19-15(18)13-4-3-11(16)8-14(13)17/h3-8H,1-2H3 |
| InChIKey | ZPUYTAOTVOKVSZ-UHFFFAOYSA-N |
| SMILES | C=1C(=CC(=CC1C)C)OC(C=1C(=CC(=CC1)Cl)Cl)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.814885 |