| SpectraBase Compound ID | DECGS82iwJm |
|---|---|
| InChI | InChI=1S/C9H11N.Cl/c1-2-4-9-7-10-6-5-8(9)3-1;/h1-4,10H,5-7H2; |
| InChIKey | IPOCZSWQEQDAJJ-UHFFFAOYSA-N |
| Mol Weight | 168.65 g/mol |
| Molecular Formula | C9H11ClN |
| Exact Mass | 168.058002 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | 7QC4DbAThYS |
|---|---|
| Name | 1,2,3,4-Tetrahydroisoquinoline hydrochloride |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 168.058002058 u |
| Formula | C9H11ClN |
| InChI | InChI=1S/C9H11N.Cl/c1-2-4-9-7-10-6-5-8(9)3-1;/h1-4,10H,5-7H2; |
| InChIKey | IPOCZSWQEQDAJJ-UHFFFAOYSA-N |
| Molecular Weight | 168.647 g/mol |
| Nominal Mass | 168 u |
| SMILES | [Cl].C1NCCC=2C=CC=CC12 |
| Spectrum/Structure Validation Score (Raman) | 0.991971 |