| SpectraBase Compound ID | 6sKSua7EjTP |
|---|---|
| InChI | InChI=1S/C20H29Cl2NO2/c1-3-5-7-12-18(24)23(19(25)13-8-6-4-2)15-14-16-10-9-11-17(21)20(16)22/h9-11H,3-8,12-15H2,1-2H3 |
| InChIKey | UQXHTSNLYHJNQK-UHFFFAOYSA-N |
| Mol Weight | 386.36 g/mol |
| Molecular Formula | C20H29Cl2NO2 |
| Exact Mass | 385.157535 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1YIDOR1y5bx |
|---|---|
| Name | 2,3-Dichlorophenethylamine 2hex |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 385.157534576 u |
| Formula | C20H29Cl2NO2 |
| InChI | InChI=1S/C20H29Cl2NO2/c1-3-5-7-12-18(24)23(19(25)13-8-6-4-2)15-14-16-10-9-11-17(21)20(16)22/h9-11H,3-8,12-15H2,1-2H3 |
| InChIKey | UQXHTSNLYHJNQK-UHFFFAOYSA-N |
| Molecular Weight | 386.363 g/mol |
| SMILES | C=1(C(=C(C=CC1)Cl)Cl)CCN(C(CCCCC)=O)C(CCCCC)=O |