| SpectraBase Compound ID | 9VLiJEMmOem |
|---|---|
| InChI | InChI=1S/C10H11FO3/c1-7(12)14-6-8-3-4-10(13-2)9(11)5-8/h3-5H,6H2,1-2H3 |
| InChIKey | XOWFOOZSPRAPDA-UHFFFAOYSA-N |
| Mol Weight | 198.19 g/mol |
| Molecular Formula | C10H11FO3 |
| Exact Mass | 198.069222 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 | 8sbhUnNXzZf |
|---|---|
| Name | Benzoic alcohol, 3-fluoro-4-methoxy-, acetate |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 198.069222374 u |
| Formula | C10H11FO3 |
| InChI | InChI=1S/C10H11FO3/c1-7(12)14-6-8-3-4-10(13-2)9(11)5-8/h3-5H,6H2,1-2H3 |
| InChIKey | XOWFOOZSPRAPDA-UHFFFAOYSA-N |
| Molecular Weight | 198.193 g/mol |
| SMILES | C1=C(C=C(C(=C1)OC)F)COC(=O)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.944227 |