| SpectraBase Compound ID | EE5x84HiiVc |
|---|---|
| InChI | InChI=1S/C12H16O3/c1-5-6-9-7-10(13-2)12(15-4)11(8-9)14-3/h5-8H,1-4H3/b6-5- |
| InChIKey | RRXOQHQFJOQLQR-WAYWQWQTSA-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 | CaY3GAoA0Xp |
|---|---|
| Name | 1,2,3-Trimethoxy-5(1-propenyl)benzene |
| 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/c1-5-6-9-7-10(13-2)12(15-4)11(8-9)14-3/h5-8H,1-4H3/b6-5- |
| InChIKey | RRXOQHQFJOQLQR-WAYWQWQTSA-N |
| Molecular Weight | 208.257 g/mol |
| SMILES | C1(=C(C(=CC(=C1)\C=C/C)OC)OC)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.973913 |