| SpectraBase Compound ID | GyREurxKkOR |
|---|---|
| InChI | InChI=1S/C11H7BrO3/c12-8-2-1-6-5-10(13)9(11(14)15)4-7(6)3-8/h1-5,13H,(H,14,15) |
| InChIKey | XZWXQSGFZHRDNB-UHFFFAOYSA-N |
| Mol Weight | 267.08 g/mol |
| Molecular Formula | C11H7BrO3 |
| Exact Mass | 265.957857 g/mol |
| SpectraBase Spectrum ID | 7B4xBWT8Tl5 |
|---|---|
| Name | 7-Bromo-3-hydroxy-2-naphthoic acid |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 265.957857082 u |
| Formula | C11H7BrO3 |
| InChI | InChI=1S/C11H7BrO3/c12-8-2-1-6-5-10(13)9(11(14)15)4-7(6)3-8/h1-5,13H,(H,14,15) |
| InChIKey | XZWXQSGFZHRDNB-UHFFFAOYSA-N |
| SMILES | OC(C1=CC=2C=C(C=CC2C=C1O)Br)=O |
| Spectrum/Structure Validation Score (Raman) | 0.829105 |