| SpectraBase Compound ID | BbtpcsGjlYz |
|---|---|
| InChI | InChI=1S/C8H8O4/c1-12-8(11)7-5(9)3-2-4-6(7)10/h2-4,9-10H,1H3 |
| InChIKey | WCQZCKUNZVMBDC-UHFFFAOYSA-N |
| Mol Weight | 168.15 g/mol |
| Molecular Formula | C8H8O4 |
| Exact Mass | 168.042259 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | Klc7QcCJjk1 |
|---|---|
| Name | Methyl-2,6-dihydroxybenzoate |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 168.042258734 u |
| Formula | C8H8O4 |
| InChI | InChI=1S/C8H8O4/c1-12-8(11)7-5(9)3-2-4-6(7)10/h2-4,9-10H,1H3 |
| InChIKey | WCQZCKUNZVMBDC-UHFFFAOYSA-N |
| Molecular Weight | 168.148 g/mol |
| SMILES | C(=O)(C=1C(O)=CC=CC1O)OC |
| Spectrum/Structure Validation Score (Raman) | 0.733303 |