| SpectraBase Compound ID | 23vQ9dvG6pl |
|---|---|
| InChI | InChI=1S/C14H18F3NO4/c1-4-22-12-8-10(20-2)9(7-11(12)21-3)5-6-18-13(19)14(15,16)17/h7-8H,4-6H2,1-3H3,(H,18,19) |
| InChIKey | TXZYUGZOSOXVHZ-UHFFFAOYSA-N |
| Mol Weight | 321.3 g/mol |
| Molecular Formula | C14H18F3NO4 |
| Exact Mass | 321.118793 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 5h7GIdcbLyA |
|---|---|
| Name | 2C-o-2 tfa |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 321.118792549 u |
| Formula | C14H18F3NO4 |
| InChI | InChI=1S/C14H18F3NO4/c1-4-22-12-8-10(20-2)9(7-11(12)21-3)5-6-18-13(19)14(15,16)17/h7-8H,4-6H2,1-3H3,(H,18,19) |
| InChIKey | TXZYUGZOSOXVHZ-UHFFFAOYSA-N |
| Molecular Weight | 321.296 g/mol |
| SMILES | C=1(C(=CC(=C(C1)OC)OCC)OC)CCNC(C(F)(F)F)=O |