| SpectraBase Compound ID | 3K1W2oWwAUH |
|---|---|
| InChI | InChI=1S/C8H18ClN/c1-3-6-10(7-4-2)8-5-9/h3-8H2,1-2H3 |
| InChIKey | QKWHKHPUGFKVCP-UHFFFAOYSA-N |
| Mol Weight | 163.69 g/mol |
| Molecular Formula | C8H18ClN |
| Exact Mass | 163.112777 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | uImPzDGDf9 |
|---|---|
| Name | N,N-Dipropyl aminoethyl-2-chloride |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 163.112777284 u |
| Formula | C8H18ClN |
| InChI | InChI=1S/C8H18ClN/c1-3-6-10(7-4-2)8-5-9/h3-8H2,1-2H3 |
| InChIKey | QKWHKHPUGFKVCP-UHFFFAOYSA-N |
| Molecular Weight | 163.692 g/mol |
| SMILES | CCCN(CCCl)CCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.963832 |