| SpectraBase Compound ID | FcY2NdfrhMS |
|---|---|
| InChI | InChI=1S/C16H25ClN2/c1-2-3-4-5-9-18-10-12-19(13-11-18)16-8-6-7-15(17)14-16/h6-8,14H,2-5,9-13H2,1H3 |
| InChIKey | QTPPYQBUYPBJIC-UHFFFAOYSA-N |
| Mol Weight | 280.84 g/mol |
| Molecular Formula | C16H25ClN2 |
| Exact Mass | 280.170627 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1zGhYzLX7YU |
|---|---|
| Name | 1-(3-Chlorophenyl)-4-hexylpiperazine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 280.170626513 u |
| Formula | C16H25ClN2 |
| InChI | InChI=1S/C16H25ClN2/c1-2-3-4-5-9-18-10-12-19(13-11-18)16-8-6-7-15(17)14-16/h6-8,14H,2-5,9-13H2,1H3 |
| InChIKey | QTPPYQBUYPBJIC-UHFFFAOYSA-N |
| SMILES | C1=C(C=C(C=C1)Cl)N1CCN(CC1)CCCCCC |