| SpectraBase Compound ID | 8EIZMpozwZf |
|---|---|
| InChI | InChI=1S/C10H12O5/c1-13-6-4-7(11)9(10(12)15-3)8(5-6)14-2/h4-5,11H,1-3H3 |
| InChIKey | FLOLRRPLSHXXMQ-UHFFFAOYSA-N |
| Mol Weight | 212.2 g/mol |
| Molecular Formula | C10H12O5 |
| Exact Mass | 212.068473 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | JpOrfepZ7hv |
|---|---|
| Name | 4,6-Dimethoxysalicylic acid, methyl ester |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 212.068473481 u |
| Formula | C10H12O5 |
| InChI | InChI=1S/C10H12O5/c1-13-6-4-7(11)9(10(12)15-3)8(5-6)14-2/h4-5,11H,1-3H3 |
| InChIKey | FLOLRRPLSHXXMQ-UHFFFAOYSA-N |
| Molecular Weight | 212.201 g/mol |
| SMILES | OC1=CC(=CC(=C1C(OC)=O)OC)OC |
| Spectrum/Structure Validation Score (Raman) | 0.854004 |