| SpectraBase Compound ID | 2yM3TVGfsiJ |
|---|---|
| InChI | InChI=1S/C10H14BrN.ClH/c1-2-4-10(12)8-5-3-6-9(11)7-8;/h3,5-7,10H,2,4,12H2,1H3;1H |
| InChIKey | RCQYWHKHAXUSEL-UHFFFAOYSA-N |
| Mol Weight | 264.59 g/mol |
| Molecular Formula | C10H15BrClN |
| Exact Mass | 263.00764 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | IdMXqsjohvd |
|---|---|
| Name | m-Bromo-alpha-propylbenzylamine, hydrochloride |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 263.007640187 u |
| Formula | C10H15BrClN |
| InChI | InChI=1S/C10H14BrN.ClH/c1-2-4-10(12)8-5-3-6-9(11)7-8;/h3,5-7,10H,2,4,12H2,1H3;1H |
| InChIKey | RCQYWHKHAXUSEL-UHFFFAOYSA-N |
| SMILES | NC(C=1C=CC=C(C1)Br)CCC.Cl |
| Spectrum/Structure Validation Score (Raman) | 0.978106 |