| SpectraBase Compound ID | 6qQVmELYMDa |
|---|---|
| InChI | InChI=1S/C10H10O5/c1-13-9(11)7-5-3-4-6-8(7)15-10(12)14-2/h3-6H,1-2H3 |
| InChIKey | ZTUQPXFCZFUTTO-UHFFFAOYSA-N |
| Mol Weight | 210.18 g/mol |
| Molecular Formula | C10H10O5 |
| Exact Mass | 210.052823 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 85CtqwyhYj2 |
|---|---|
| Name | Salicylic acid, o-carbomethoxy-, methyl ester |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 210.052823417 u |
| Formula | C10H10O5 |
| InChI | InChI=1S/C10H10O5/c1-13-9(11)7-5-3-4-6-8(7)15-10(12)14-2/h3-6H,1-2H3 |
| InChIKey | ZTUQPXFCZFUTTO-UHFFFAOYSA-N |
| Molecular Weight | 210.185 g/mol |
| SMILES | C1=CC(C(=O)OC)=C(C=C1)OC(=O)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.972961 |