| SpectraBase Compound ID | EVa35uHMJyL |
|---|---|
| InChI | InChI=1S/C11H14O3/c1-7-5-10(13-4)6-8(2)11(7)14-9(3)12/h5-6H,1-4H3 |
| InChIKey | XUJDRPFZRFFGGV-UHFFFAOYSA-N |
| Mol Weight | 194.23 g/mol |
| Molecular Formula | C11H14O3 |
| Exact Mass | 194.094294 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | E092EoE1fS9 |
|---|---|
| Name | 4-Methoxy-2,6-dimethylphenol, acetate |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 194.094294308 u |
| Formula | C11H14O3 |
| InChI | InChI=1S/C11H14O3/c1-7-5-10(13-4)6-8(2)11(7)14-9(3)12/h5-6H,1-4H3 |
| InChIKey | XUJDRPFZRFFGGV-UHFFFAOYSA-N |
| Molecular Weight | 194.230 g/mol |
| SMILES | COC1=CC(=C(C(=C1)C)OC(=O)C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.826865 |