| SpectraBase Compound ID | 7T9dfjqOWfC |
|---|---|
| InChI | InChI=1S/C16H17FN4O/c17-13-4-3-5-14(12-13)19-16(22)21-10-8-20(9-11-21)15-6-1-2-7-18-15/h1-7,12H,8-11H2,(H,19,22) |
| InChIKey | WVLRESJNSPOMBE-UHFFFAOYSA-N |
| Mol Weight | 300.34 g/mol |
| Molecular Formula | C16H17FN4O |
| Exact Mass | 300.138639 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | LQjBrcjGcBN |
|---|---|
| Name | N-(3-Fluorophenyl)-4-(2-pyridinyl)-1-piperazinecarboxamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 300.138639345 u |
| Formula | C16H17FN4O |
| InChI | InChI=1S/C16H17FN4O/c17-13-4-3-5-14(12-13)19-16(22)21-10-8-20(9-11-21)15-6-1-2-7-18-15/h1-7,12H,8-11H2,(H,19,22) |
| InChIKey | WVLRESJNSPOMBE-UHFFFAOYSA-N |
| Molecular Weight | 300.337 g/mol |
| SMILES | N(C(N1CCN(CC1)C1=NC=CC=C1)=O)C1=CC(F)=CC=C1 |