| SpectraBase Compound ID | LanIEO1NlJy |
|---|---|
| InChI | InChI=1S/C6H12ClN/c7-3-6-8-4-1-2-5-8/h1-6H2 |
| InChIKey | RMGFLMXDCGQKPS-UHFFFAOYSA-N |
| Mol Weight | 133.62 g/mol |
| Molecular Formula | C6H12ClN |
| Exact Mass | 133.065827 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | DJJX6P2X52W |
|---|---|
| Name | Pyrrolidine, 1-(2-chloroethyl)- |
| 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/c7-3-6-8-4-1-2-5-8/h1-6H2 |
| InChIKey | RMGFLMXDCGQKPS-UHFFFAOYSA-N |
| Molecular Weight | 133.622 g/mol |
| SMILES | C(CN1CCCC1)Cl |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.909915 |