| SpectraBase Compound ID | BIiDgebwjL7 |
|---|---|
| InChI | InChI=1S/C6H12ClN/c1-8-4-2-6(7)3-5-8/h6H,2-5H2,1H3 |
| InChIKey | MYGXGCCFTPKWIH-UHFFFAOYSA-N |
| Mol Weight | 133.62 g/mol |
| Molecular Formula | C6H12ClN |
| Exact Mass | 133.065827 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | CxoZ5WRh55R |
|---|---|
| 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 | 133.065827090 u |
| Formula | C6H12ClN |
| InChI | InChI=1S/C6H12ClN/c1-8-4-2-6(7)3-5-8/h6H,2-5H2,1H3 |
| InChIKey | MYGXGCCFTPKWIH-UHFFFAOYSA-N |
| Molecular Weight | 133.622 g/mol |
| SMILES | C1(Cl)CCN(CC1)C |
| Spectrum/Structure Validation Score (Raman) | 0.960517 |