| SpectraBase Compound ID | 7gEDgPy9Fn1 |
|---|---|
| InChI | InChI=1S/C14H19FN2O/c15-13-5-3-12(4-6-13)14(18)2-1-9-17-10-7-16-8-11-17/h3-6,16H,1-2,7-11H2 |
| InChIKey | POWKNAVDGFNMSG-UHFFFAOYSA-N |
| Mol Weight | 250.32 g/mol |
| Molecular Formula | C14H19FN2O |
| Exact Mass | 250.148141 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7mJfj2SYv77 |
|---|---|
| Name | 1-Butanone, 1-(4-fluorophenyl)-4-(1-piperazinyl)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 250.148141402 u |
| Formula | C14H19FN2O |
| InChI | InChI=1S/C14H19FN2O/c15-13-5-3-12(4-6-13)14(18)2-1-9-17-10-7-16-8-11-17/h3-6,16H,1-2,7-11H2 |
| InChIKey | POWKNAVDGFNMSG-UHFFFAOYSA-N |
| Molecular Weight | 250.317 g/mol |
| SMILES | C1NCCN(C1)CCCC(C1=CC=C(C=C1)F)=O |