| SpectraBase Compound ID | KfreaIVkWp3 |
|---|---|
| InChI | InChI=1S/C9H10O3/c1-6-3-4-7(9(10)11)8(5-6)12-2/h3-5H,1-2H3,(H,10,11) |
| InChIKey | SOWDWUPMHVDZGL-UHFFFAOYSA-N |
| Mol Weight | 166.18 g/mol |
| Molecular Formula | C9H10O3 |
| Exact Mass | 166.062994 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | 74PhOkroCFN |
|---|---|
| Name | 4-Methyl-o-anisic acid |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 166.062994179 u |
| Formula | C9H10O3 |
| InChI | InChI=1S/C9H10O3/c1-6-3-4-7(9(10)11)8(5-6)12-2/h3-5H,1-2H3,(H,10,11) |
| InChIKey | SOWDWUPMHVDZGL-UHFFFAOYSA-N |
| SMILES | OC(C1=C(C=C(C=C1)C)OC)=O |
| Spectrum/Structure Validation Score (Raman) | 0.992254 |