![2-[(p-Chlorobenzyl)thio]-2-imidazoline, monohydrochloride](/api/spectrum/A5IwQvijFk0/structure.png?h=300&w=458 "2-[(p-Chlorobenzyl)thio]-2-imidazoline, monohydrochloride")
| SpectraBase Compound ID | D2ulpTOZMie |
|---|---|
| InChI | InChI=1S/C10H11ClN2S.ClH/c11-9-3-1-8(2-4-9)7-14-10-12-5-6-13-10;/h1-4H,5-7H2,(H,12,13);1H |
| InChIKey | JJXGUTICWGDKQS-UHFFFAOYSA-N |
| Mol Weight | 263.19 g/mol |
| Molecular Formula | C10H12Cl2N2S |
| Exact Mass | 262.009825 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | A5IwQvijFk0 |
|---|---|
| Name | 2-[(p-Chlorobenzyl)thio]-2-imidazoline, monohydrochloride |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 262.009824968 u |
| Formula | C10H12Cl2N2S |
| InChI | InChI=1S/C10H11ClN2S.ClH/c11-9-3-1-8(2-4-9)7-14-10-12-5-6-13-10;/h1-4H,5-7H2,(H,12,13);1H |
| InChIKey | JJXGUTICWGDKQS-UHFFFAOYSA-N |
| SMILES | Cl.N1C(=NCC1)SCC=1C=CC(=CC1)Cl |
| Spectrum/Structure Validation Score (Raman) | 0.728959 |