| SpectraBase Compound ID | JZOMtzURXHZ |
|---|---|
| InChI | InChI=1S/C8H11BO3/c1-6-3-4-8(12-2)7(5-6)9(10)11/h3-5,10-11H,1-2H3 |
| InChIKey | CSVKZOZMPSRLTC-UHFFFAOYSA-N |
| Mol Weight | 166.0 g/mol |
| Molecular Formula | C8H11BO3 |
| Exact Mass | 166.080124 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | 1NiL1CFmgjD |
|---|---|
| Name | 2-Methoxy-5-methylphenylboronic acid |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 166.080124381 u |
| Formula | C8H11BO3 |
| InChI | InChI=1S/C8H11BO3/c1-6-3-4-8(12-2)7(5-6)9(10)11/h3-5,10-11H,1-2H3 |
| InChIKey | CSVKZOZMPSRLTC-UHFFFAOYSA-N |
| Molecular Weight | 165.983 g/mol |
| SMILES | COC1=C(C=C(C=C1)C)B(O)O |
| Spectrum/Structure Validation Score (Raman) | 0.885611 |