| SpectraBase Compound ID | Gsl5gXMywMl |
|---|---|
| InChI | InChI=1S/C20H33Cl2N/c1-3-5-7-9-15-23(16-10-8-6-4-2)17-14-18-19(21)12-11-13-20(18)22/h11-13H,3-10,14-17H2,1-2H3 |
| InChIKey | MPRQLKKYSHVZAO-UHFFFAOYSA-N |
| Mol Weight | 358.4 g/mol |
| Molecular Formula | C20H33Cl2N |
| Exact Mass | 357.199005 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3cm8VIj6Q60 |
|---|---|
| Name | N,N-Hexyl-2,6-dichlorophenethylamine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 357.199005467 u |
| Formula | C20H33Cl2N |
| InChI | InChI=1S/C20H33Cl2N/c1-3-5-7-9-15-23(16-10-8-6-4-2)17-14-18-19(21)12-11-13-20(18)22/h11-13H,3-10,14-17H2,1-2H3 |
| InChIKey | MPRQLKKYSHVZAO-UHFFFAOYSA-N |
| Molecular Weight | 358.397 g/mol |
| SMILES | C1(=C(C=CC=C1Cl)Cl)CCN(CCCCCC)CCCCCC |