| SpectraBase Compound ID | 2uH6xvgMXeS |
|---|---|
| InChI | InChI=1S/C6H9N3.3ClH/c7-4-1-5(8)3-6(9)2-4;;;/h1-3H,7-9H2;3*1H |
| InChIKey | GSPBVFMIOSWQJB-UHFFFAOYSA-N |
| Mol Weight | 232.54 g/mol |
| Molecular Formula | C6H12Cl3N3 |
| Exact Mass | 231.00968 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | EfvJA6Y1Qd0 |
|---|---|
| Name | 1,3,5-Benzenetriamine, trihydrochloride |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 231.009680498 u |
| Formula | C6H12Cl3N3 |
| InChI | InChI=1S/C6H9N3.3ClH/c7-4-1-5(8)3-6(9)2-4;;;/h1-3H,7-9H2;3*1H |
| InChIKey | GSPBVFMIOSWQJB-UHFFFAOYSA-N |
| SMILES | NC=1C=C(C=C(C1)N)N.Cl.Cl.Cl |
| Spectrum/Structure Validation Score (Raman) | 0.870539 |