| SpectraBase Compound ID | 3b8m7v7NYqg |
|---|---|
| InChI | InChI=1S/C14H21BrClN/c1-13(2,3)8-7-9(14(4,5)6)11(16)12(17)10(8)15/h7H,17H2,1-6H3 |
| InChIKey | HKHQNHKBDKWDFI-UHFFFAOYSA-N |
| Mol Weight | 318.69 g/mol |
| Molecular Formula | C14H21BrClN |
| Exact Mass | 317.05459 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | 2sunaHmdObt |
|---|---|
| Name | 2-Bromo-6-chloro-3,5-di-tert-butylaniline |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 317.054590380 u |
| Formula | C14H21BrClN |
| InChI | InChI=1S/C14H21BrClN/c1-13(2,3)8-7-9(14(4,5)6)11(16)12(17)10(8)15/h7H,17H2,1-6H3 |
| InChIKey | HKHQNHKBDKWDFI-UHFFFAOYSA-N |
| SMILES | NC1=C(C(=CC(=C1Cl)C(C)(C)C)C(C)(C)C)Br |
| Spectrum/Structure Validation Score (Raman) | 0.94428 |