| SpectraBase Compound ID | HRfyPG3GdOB |
|---|---|
| InChI | InChI=1S/C14H15F3N2O/c1-3-8-19(9-4-2)13(20)18-12-7-5-6-11(10-12)14(15,16)17/h3-7,10H,1-2,8-9H2,(H,18,20) |
| InChIKey | PXNZFOSKKIVWFW-UHFFFAOYSA-N |
| Mol Weight | 284.28 g/mol |
| Molecular Formula | C14H15F3N2O |
| Exact Mass | 284.113648 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DenhOb2DOMc |
|---|---|
| Name | 1,1-Diallyl-3-(alpha,alpha,alpha-trifluoro-m-tolyl)urea |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 284.113647599 u |
| Formula | C14H15F3N2O |
| InChI | InChI=1S/C14H15F3N2O/c1-3-8-19(9-4-2)13(20)18-12-7-5-6-11(10-12)14(15,16)17/h3-7,10H,1-2,8-9H2,(H,18,20) |
| InChIKey | PXNZFOSKKIVWFW-UHFFFAOYSA-N |
| Molecular Weight | 284.282 g/mol |
| SMILES | N(C1=CC=CC(=C1)C(F)(F)F)C(N(CC=C)CC=C)=O |