| SpectraBase Compound ID | Ivs03kSbBOq |
|---|---|
| InChI | InChI=1S/C8H16ClN.ClH/c1-7(2)10-5-3-8(9)4-6-10;/h7-8H,3-6H2,1-2H3;1H |
| InChIKey | LCTREUOQPGTIID-UHFFFAOYSA-N |
| Mol Weight | 198.14 g/mol |
| Molecular Formula | C8H17Cl2N |
| Exact Mass | 197.073805 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | IpN7k6KAQds |
|---|---|
| Name | 4-Chloro-1-isopropylpiperidine, hydrochloride |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 197.073804951 u |
| Formula | C8H17Cl2N |
| InChI | InChI=1S/C8H16ClN.ClH/c1-7(2)10-5-3-8(9)4-6-10;/h7-8H,3-6H2,1-2H3;1H |
| InChIKey | LCTREUOQPGTIID-UHFFFAOYSA-N |
| Molecular Weight | 198.137 g/mol |
| SMILES | CC(N1CCC(CC1)Cl)C.Cl |
| Spectrum/Structure Validation Score (Raman) | 0.966214 |