| SpectraBase Compound ID | GAHQTp8epDW |
|---|---|
| InChI | InChI=1S/C12H17FO/c1-12(2,3)14-9-8-10-4-6-11(13)7-5-10/h4-7H,8-9H2,1-3H3 |
| InChIKey | YWSQBIKHOXRNJO-UHFFFAOYSA-N |
| Mol Weight | 196.27 g/mol |
| Molecular Formula | C12H17FO |
| Exact Mass | 196.126343 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 5AhQORkpgHn |
|---|---|
| Name | 4-Fluorophenethyl alcohol, tert.-butyl ether |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 196.126343329 u |
| Formula | C12H17FO |
| InChI | InChI=1S/C12H17FO/c1-12(2,3)14-9-8-10-4-6-11(13)7-5-10/h4-7H,8-9H2,1-3H3 |
| InChIKey | YWSQBIKHOXRNJO-UHFFFAOYSA-N |
| Molecular Weight | 196.265 g/mol |
| SMILES | C1(=CC=C(C=C1)F)CCOC(C)(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.940396 |