| SpectraBase Compound ID | 7i2G6Ij309J |
|---|---|
| InChI | InChI=1S/C6H12ClN.ClH/c1-8-4-2-6(7)3-5-8;/h6H,2-5H2,1H3;1H |
| InChIKey | QDOJNWFOCOWAPO-UHFFFAOYSA-N |
| Mol Weight | 170.08 g/mol |
| Molecular Formula | C6H13Cl2N |
| Exact Mass | 169.042505 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | Lip5MTCpfze |
|---|---|
| Name | 4-Chloro-1-methylpiperidine, hydrochloride |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 169.042504823 u |
| Formula | C6H13Cl2N |
| InChI | InChI=1S/C6H12ClN.ClH/c1-8-4-2-6(7)3-5-8;/h6H,2-5H2,1H3;1H |
| InChIKey | QDOJNWFOCOWAPO-UHFFFAOYSA-N |
| SMILES | Cl.C1CN(CCC1Cl)C |
| Spectrum/Structure Validation Score (Raman) | 0.971207 |