| SpectraBase Compound ID | 25qQpmU1but |
|---|---|
| InChI | InChI=1S/C12H16O3/c1-4-8-15-10-6-7-11(13-3)12(9-10)14-5-2/h4,6-7,9H,1,5,8H2,2-3H3 |
| InChIKey | WLZGIAMXWKPKCP-UHFFFAOYSA-N |
| Mol Weight | 208.26 g/mol |
| Molecular Formula | C12H16O3 |
| Exact Mass | 208.109944 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 31VXOABon4K |
|---|---|
| Name | 4-Allyloxy-2-ethoxy-1-methoxybenzene |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 208.109944372 u |
| Formula | C12H16O3 |
| InChI | InChI=1S/C12H16O3/c1-4-8-15-10-6-7-11(13-3)12(9-10)14-5-2/h4,6-7,9H,1,5,8H2,2-3H3 |
| InChIKey | WLZGIAMXWKPKCP-UHFFFAOYSA-N |
| Molecular Weight | 208.257 g/mol |
| SMILES | C1=C(C(=CC=C1OCC=C)OC)OCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.93459 |