| SpectraBase Compound ID | 4bfEJ6HVHMa |
|---|---|
| InChI | InChI=1S/C11H13FO2/c1-8(2)11(13)14-7-9-3-5-10(12)6-4-9/h3-6,8H,7H2,1-2H3 |
| InChIKey | BHMCVQYFUKPYCN-UHFFFAOYSA-N |
| Mol Weight | 196.22 g/mol |
| Molecular Formula | C11H13FO2 |
| Exact Mass | 196.089958 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 6yCgweyy4CP |
|---|---|
| Name | 4-Fluorobenzyl alcohol, 2-methylpropionate |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 196.089957820 u |
| Formula | C11H13FO2 |
| InChI | InChI=1S/C11H13FO2/c1-8(2)11(13)14-7-9-3-5-10(12)6-4-9/h3-6,8H,7H2,1-2H3 |
| InChIKey | BHMCVQYFUKPYCN-UHFFFAOYSA-N |
| Molecular Weight | 196.221 g/mol |
| SMILES | C1=CC(=CC=C1COC(C(C)C)=O)F |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.840681 |