| SpectraBase Compound ID | FbILjU4BKMC |
|---|---|
| InChI | InChI=1S/C8H9FN2O/c9-7-3-1-6(2-4-7)5-11-8(10)12/h1-4H,5H2,(H3,10,11,12) |
| InChIKey | ISIFPVOJHJASJW-UHFFFAOYSA-N |
| Mol Weight | 168.17 g/mol |
| Molecular Formula | C8H9FN2O |
| Exact Mass | 168.069891 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Ld57bXY2lET |
|---|---|
| Name | 4-Fluorobenzylurea |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 168.069891080 u |
| Formula | C8H9FN2O |
| InChI | InChI=1S/C8H9FN2O/c9-7-3-1-6(2-4-7)5-11-8(10)12/h1-4H,5H2,(H3,10,11,12) |
| InChIKey | ISIFPVOJHJASJW-UHFFFAOYSA-N |
| Molecular Weight | 168.171 g/mol |
| SMILES | N(CC1=CC=C(C=C1)F)C(N)=O |