| SpectraBase Compound ID | 3E9bKhta6uf |
|---|---|
| InChI | InChI=1S/C7H6F2N2O/c8-5-2-1-4(3-6(5)9)11-7(10)12/h1-3H,(H3,10,11,12) |
| InChIKey | LSVNHNDOMDZASQ-UHFFFAOYSA-N |
| Mol Weight | 172.13 g/mol |
| Molecular Formula | C7H6F2N2O |
| Exact Mass | 172.044819 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8llVM1rcz3Q |
|---|---|
| Name | (3,4-Difluorophenyl)urea |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 172.044819146 u |
| Formula | C7H6F2N2O |
| InChI | InChI=1S/C7H6F2N2O/c8-5-2-1-4(3-6(5)9)11-7(10)12/h1-3H,(H3,10,11,12) |
| InChIKey | LSVNHNDOMDZASQ-UHFFFAOYSA-N |
| Molecular Weight | 172.135 g/mol |
| SMILES | N(C=1C=C(F)C(F)=CC1)C(=O)N |