![1-[1-(4-Chlorophenyl)ethyl]piperazine](/api/spectrum/6Mef297Kou3/structure.png?h=300&w=458 "1-[1-(4-Chlorophenyl)ethyl]piperazine")
| SpectraBase Compound ID | H4kv1boIYf5 |
|---|---|
| InChI | InChI=1S/C12H17ClN2/c1-10(15-8-6-14-7-9-15)11-2-4-12(13)5-3-11/h2-5,10,14H,6-9H2,1H3 |
| InChIKey | TXDDMVIATVZSAM-UHFFFAOYSA-N |
| Mol Weight | 224.73 g/mol |
| Molecular Formula | C12H17ClN2 |
| Exact Mass | 224.108026 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6Mef297Kou3 |
|---|---|
| Name | 1-[1-(4-Chlorophenyl)ethyl]piperazine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 224.108026255 u |
| Formula | C12H17ClN2 |
| InChI | InChI=1S/C12H17ClN2/c1-10(15-8-6-14-7-9-15)11-2-4-12(13)5-3-11/h2-5,10,14H,6-9H2,1H3 |
| InChIKey | TXDDMVIATVZSAM-UHFFFAOYSA-N |
| Molecular Weight | 224.735 g/mol |
| SMILES | C(C)(C1=CC=C(C=C1)Cl)N1CCNCC1 |