| SpectraBase Compound ID | 9r5My7DQAix |
|---|---|
| InChI | InChI=1S/C9H8F2O3/c1-2-13-9(12)14-8-4-6(10)3-7(11)5-8/h3-5H,2H2,1H3 |
| InChIKey | JNQNBNWVOCKDKL-UHFFFAOYSA-N |
| Mol Weight | 202.16 g/mol |
| Molecular Formula | C9H8F2O3 |
| Exact Mass | 202.04415 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 8Ygh3XGRWNF |
|---|---|
| Name | Carbonic acid, ethyl 3,5-difluophenyl ester |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 202.044150441 u |
| Formula | C9H8F2O3 |
| InChI | InChI=1S/C9H8F2O3/c1-2-13-9(12)14-8-4-6(10)3-7(11)5-8/h3-5H,2H2,1H3 |
| InChIKey | JNQNBNWVOCKDKL-UHFFFAOYSA-N |
| Molecular Weight | 202.157 g/mol |
| SMILES | CCOC(=O)OC1=CC(=CC(=C1)F)F |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.844321 |