| SpectraBase Compound ID | DdGvNUZvehT |
|---|---|
| InChI | InChI=1S/C12H14O4/c1-7-8(2)12(16-10(4)14)6-5-11(7)15-9(3)13/h5-6H,1-4H3 |
| InChIKey | QYBHLPOAUPBPFR-UHFFFAOYSA-N |
| Mol Weight | 222.24 g/mol |
| Molecular Formula | C12H14O4 |
| Exact Mass | 222.089209 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | BOBaQLjxw2B |
|---|---|
| Name | 2,3-Dimethylhydroquinone, diacetate |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 222.089208927 u |
| Formula | C12H14O4 |
| InChI | InChI=1S/C12H14O4/c1-7-8(2)12(16-10(4)14)6-5-11(7)15-9(3)13/h5-6H,1-4H3 |
| InChIKey | QYBHLPOAUPBPFR-UHFFFAOYSA-N |
| Molecular Weight | 222.240 g/mol |
| SMILES | CC1=C(C)C(OC(C)=O)=CC=C1OC(C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.88238 |