![3-[(7-Chloro-4-quinolyl)amino]-1-propanol](/api/spectrum/2EMd9zRWgw8/structure.png?h=300&w=458 "3-[(7-Chloro-4-quinolyl)amino]-1-propanol")
| SpectraBase Compound ID | 2LDIxaMIGLt |
|---|---|
| InChI | InChI=1S/C12H13ClN2O/c13-9-2-3-10-11(14-5-1-7-16)4-6-15-12(10)8-9/h2-4,6,8,16H,1,5,7H2,(H,14,15) |
| InChIKey | MCVPFDOUKZBWJF-UHFFFAOYSA-N |
| Mol Weight | 236.7 g/mol |
| Molecular Formula | C12H13ClN2O |
| Exact Mass | 236.071641 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2EMd9zRWgw8 |
|---|---|
| Name | 3-[(7-Chloro-4-quinolyl)amino]-1-propanol |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 236.071640746 u |
| Formula | C12H13ClN2O |
| InChI | InChI=1S/C12H13ClN2O/c13-9-2-3-10-11(14-5-1-7-16)4-6-15-12(10)8-9/h2-4,6,8,16H,1,5,7H2,(H,14,15) |
| InChIKey | MCVPFDOUKZBWJF-UHFFFAOYSA-N |
| Molecular Weight | 236.702 g/mol |
| SMILES | N(CCCO)C1=CC=NC=2C=C(C=CC12)Cl |