| SpectraBase Compound ID | 9mc1501hycr |
|---|---|
| InChI | InChI=1S/C11H15Br/c1-11(2,3)10-6-4-9(8-12)5-7-10/h4-7H,8H2,1-3H3 |
| InChIKey | QZNQSIHCDAGZIA-UHFFFAOYSA-N |
| Mol Weight | 227.14 g/mol |
| Molecular Formula | C11H15Br |
| Exact Mass | 226.035713 g/mol |
Raman Spectrum
Subscribe to view the full spectrum.
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | AQSlnYGql7V |
|---|---|
| Name | alpha-Bromo-p-tert-butyltoluene |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 226.035713483 u |
| Formula | C11H15Br |
| InChI | InChI=1S/C11H15Br/c1-11(2,3)10-6-4-9(8-12)5-7-10/h4-7H,8H2,1-3H3 |
| InChIKey | QZNQSIHCDAGZIA-UHFFFAOYSA-N |
| Molecular Weight | 227.145 g/mol |
| SMILES | C=1C(=CC=C(C1)C(C)(C)C)CBr |
| Spectrum/Structure Validation Score (Raman) | 0.951732 |