![1-[2-(2-Chloroethyl)-1-piperidinyl]ethanone](/api/spectrum/CmqPcd4KbnB/structure.png?h=300&w=458 "1-[2-(2-Chloroethyl)-1-piperidinyl]ethanone")
| SpectraBase Compound ID | DsC2tz7skIV |
|---|---|
| InChI | InChI=1S/C9H16ClNO/c1-8(12)11-7-3-2-4-9(11)5-6-10/h9H,2-7H2,1H3 |
| InChIKey | LVWMBGYLNYNDLJ-UHFFFAOYSA-N |
| Mol Weight | 189.69 g/mol |
| Molecular Formula | C9H16ClNO |
| Exact Mass | 189.092042 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | CmqPcd4KbnB |
|---|---|
| Name | 1-[2-(2-Chloroethyl)-1-piperidinyl]ethanone |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 189.092041838 u |
| Formula | C9H16ClNO |
| InChI | InChI=1S/C9H16ClNO/c1-8(12)11-7-3-2-4-9(11)5-6-10/h9H,2-7H2,1H3 |
| InChIKey | LVWMBGYLNYNDLJ-UHFFFAOYSA-N |
| Molecular Weight | 189.686 g/mol |
| SMILES | C(N1C(CCCl)CCCC1)(=O)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.926676 |