| SpectraBase Compound ID | KufI6Bo6ydH |
|---|---|
| InChI | InChI=1S/C11H12O4/c1-8(13)15-11-5-3-4-9(6-12)10(11)7-14-2/h3-6H,7H2,1-2H3 |
| InChIKey | CEQPRUAOBQBNND-UHFFFAOYSA-N |
| Mol Weight | 208.21 g/mol |
| Molecular Formula | C11H12O4 |
| Exact Mass | 208.073559 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | B9n08uLgppK |
|---|---|
| Name | 3-Acetoxy-2-(methoxymethyl)-benzaldehyde |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 208.073558862 u |
| Formula | C11H12O4 |
| InChI | InChI=1S/C11H12O4/c1-8(13)15-11-5-3-4-9(6-12)10(11)7-14-2/h3-6H,7H2,1-2H3 |
| InChIKey | CEQPRUAOBQBNND-UHFFFAOYSA-N |
| Molecular Weight | 208.213 g/mol |
| SMILES | C(C=1C(=C(C=CC1)OC(=O)C)COC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.826467 |