| SpectraBase Compound ID | HU01F1phKLu |
|---|---|
| InChI | InChI=1S/C10H12O4/c1-7(11)14-9-5-4-8(12-2)6-10(9)13-3/h4-6H,1-3H3 |
| InChIKey | HARCAHUBAQTFJP-UHFFFAOYSA-N |
| Mol Weight | 196.2 g/mol |
| Molecular Formula | C10H12O4 |
| Exact Mass | 196.073559 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | IX1GeMX1p1x |
|---|---|
| Name | Phenol, 2,4-dimethoxy-, acetate |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 196.073558862 u |
| Formula | C10H12O4 |
| InChI | InChI=1S/C10H12O4/c1-7(11)14-9-5-4-8(12-2)6-10(9)13-3/h4-6H,1-3H3 |
| InChIKey | HARCAHUBAQTFJP-UHFFFAOYSA-N |
| Molecular Weight | 196.202 g/mol |
| SMILES | C(OC1=C(OC)C=C(C=C1)OC)(C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.952934 |