| SpectraBase Compound ID | 5gDMTMLbkfw |
|---|---|
| InChI | InChI=1S/C15H14BrFN2O2/c16-14-6-5-13(21-14)15(20)19-9-7-18(8-10-19)12-3-1-11(17)2-4-12/h1-6H,7-10H2 |
| InChIKey | XVBXAZDSEXKFSN-UHFFFAOYSA-N |
| Mol Weight | 353.19 g/mol |
| Molecular Formula | C15H14BrFN2O2 |
| Exact Mass | 352.022269 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3uJK0pZWQv4 |
|---|---|
| Name | 1-(5-Bromo-2-furoyl)-4-(4-fluorophenyl)piperazine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 352.022268860 u |
| Formula | C15H14BrFN2O2 |
| InChI | InChI=1S/C15H14BrFN2O2/c16-14-6-5-13(21-14)15(20)19-9-7-18(8-10-19)12-3-1-11(17)2-4-12/h1-6H,7-10H2 |
| InChIKey | XVBXAZDSEXKFSN-UHFFFAOYSA-N |
| Molecular Weight | 353.191 g/mol |
| SMILES | C=1(C(N2CCN(C3=CC=C(F)C=C3)CC2)=O)OC(Br)=CC1 |