| SpectraBase Compound ID | 9ao34KfynrV |
|---|---|
| InChI | InChI=1S/C12H16FN3O/c13-10-1-3-11(4-2-10)15-12(17)9-16-7-5-14-6-8-16/h1-4,14H,5-9H2,(H,15,17) |
| InChIKey | ICEIGLHBKQEEMG-UHFFFAOYSA-N |
| Mol Weight | 237.28 g/mol |
| Molecular Formula | C12H16FN3O |
| Exact Mass | 237.12774 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6ca1csS3ssw |
|---|---|
| Name | N-(4-Fluorophenyl)-2-(piperazin-1-yl)acetamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 237.127740309 u |
| Formula | C12H16FN3O |
| InChI | InChI=1S/C12H16FN3O/c13-10-1-3-11(4-2-10)15-12(17)9-16-7-5-14-6-8-16/h1-4,14H,5-9H2,(H,15,17) |
| InChIKey | ICEIGLHBKQEEMG-UHFFFAOYSA-N |
| Molecular Weight | 237.278 g/mol |
| SMILES | C1(F)=CC=C(C=C1)NC(=O)CN1CCNCC1 |