| SpectraBase Compound ID | GJ4gPHKQYUH |
|---|---|
| InChI | InChI=1S/C11H10FN3O2/c1-16-7-2-4-8(5-3-7)17-10-6-9(12)14-11(13)15-10/h2-6H,1H3,(H2,13,14,15) |
| InChIKey | WWBGJYVDCUZMQR-UHFFFAOYSA-N |
| Mol Weight | 235.22 g/mol |
| Molecular Formula | C11H10FN3O2 |
| Exact Mass | 235.075705 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LplOhkdiIm9 |
|---|---|
| Name | 2-Pyrimidinamine, 4-fluoro-6-(4-methoxyphenoxy)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 235.075704735 u |
| Formula | C11H10FN3O2 |
| InChI | InChI=1S/C11H10FN3O2/c1-16-7-2-4-8(5-3-7)17-10-6-9(12)14-11(13)15-10/h2-6H,1H3,(H2,13,14,15) |
| InChIKey | WWBGJYVDCUZMQR-UHFFFAOYSA-N |
| Molecular Weight | 235.218 g/mol |
| SMILES | NC=1N=C(C=C(N1)OC=1C=CC(=CC1)OC)F |