| SpectraBase Compound ID | 875KxSNWpVa |
|---|---|
| InChI | InChI=1S/C18H18F3NO2/c1-2-3-11-24-17(23)15-9-4-5-10-16(15)22-14-8-6-7-13(12-14)18(19,20)21/h4-10,12,22H,2-3,11H2,1H3 |
| InChIKey | JDLSRXWHEBFHNC-UHFFFAOYSA-N |
| Mol Weight | 337.34 g/mol |
| Molecular Formula | C18H18F3NO2 |
| Exact Mass | 337.128963 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JOxVe8Opvk5 |
|---|---|
| Name | Ufenamate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 337.128963311 u |
| Formula | C18H18F3NO2 |
| InChI | InChI=1S/C18H18F3NO2/c1-2-3-11-24-17(23)15-9-4-5-10-16(15)22-14-8-6-7-13(12-14)18(19,20)21/h4-10,12,22H,2-3,11H2,1H3 |
| InChIKey | JDLSRXWHEBFHNC-UHFFFAOYSA-N |
| Molecular Weight | 337.342 g/mol |
| SMILES | C(F)(F)(F)C1=CC(=CC=C1)NC1=C(C=CC=C1)C(=O)OCCCC |