| SpectraBase Compound ID | DIyORx5TyQU |
|---|---|
| InChI | InChI=1S/C12H12Cl2N2/c13-5-1-6-15-11-4-7-16-12-8-9(14)2-3-10(11)12/h2-4,7-8H,1,5-6H2,(H,15,16) |
| InChIKey | SNHOVCPNKMSPEJ-UHFFFAOYSA-N |
| Mol Weight | 255.15 g/mol |
| Molecular Formula | C12H12Cl2N2 |
| Exact Mass | 254.037754 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | ESVMyHX5OQn |
|---|---|
| Name | 4-(3-Chloropropyl)-7-chloroquinoline |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 254.037753794 u |
| Formula | C12H12Cl2N2 |
| InChI | InChI=1S/C12H12Cl2N2/c13-5-1-6-15-11-4-7-16-12-8-9(14)2-3-10(11)12/h2-4,7-8H,1,5-6H2,(H,15,16) |
| InChIKey | SNHOVCPNKMSPEJ-UHFFFAOYSA-N |
| Molecular Weight | 255.148 g/mol |
| SMILES | N(c1c2c(cc(cc2)Cl)ncc1)CCCCl |