| SpectraBase Compound ID | JZ4TT6fmnoX |
|---|---|
| InChI | InChI=1S/C10H12Br2O/c1-10(2,3)6-4-7(11)9(13)8(12)5-6/h4-5,13H,1-3H3 |
| InChIKey | RZYQECXFRLRRJY-UHFFFAOYSA-N |
| Mol Weight | 308.01 g/mol |
| Molecular Formula | C10H12Br2O |
| Exact Mass | 305.925491 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | FsDR4AS45bl |
|---|---|
| Name | 4-Tert-butyl-2,6-dibromophenol |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 305.925491005 u |
| Formula | C10H12Br2O |
| InChI | InChI=1S/C10H12Br2O/c1-10(2,3)6-4-7(11)9(13)8(12)5-6/h4-5,13H,1-3H3 |
| InChIKey | RZYQECXFRLRRJY-UHFFFAOYSA-N |
| Molecular Weight | 308.013 g/mol |
| SMILES | OC=1C(Br)=CC(=CC1Br)C(C)(C)C |
| Spectrum/Structure Validation Score (Raman) | 0.934357 |