| SpectraBase Compound ID | DznbCGAATjm |
|---|---|
| InChI | InChI=1S/C17H11F3O4/c18-17(19,20)16(22)23-11-6-7-14-12(8-11)13(21)9-15(24-14)10-4-2-1-3-5-10/h1-8,15H,9H2 |
| InChIKey | IMHQOSRWAGCLKT-UHFFFAOYSA-N |
| Mol Weight | 336.27 g/mol |
| Molecular Formula | C17H11F3O4 |
| Exact Mass | 336.060943 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 | 5XQQwK7m5yT |
|---|---|
| Name | 6-Hydroxyflavanone, trifluoroacetate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 336.060943319 u |
| Formula | C17H11F3O4 |
| InChI | InChI=1S/C17H11F3O4/c18-17(19,20)16(22)23-11-6-7-14-12(8-11)13(21)9-15(24-14)10-4-2-1-3-5-10/h1-8,15H,9H2 |
| InChIKey | IMHQOSRWAGCLKT-UHFFFAOYSA-N |
| Molecular Weight | 336.266 g/mol |
| SMILES | C1=C(C=CC=C1)C1CC(C2=CC(=CC=C2O1)OC(C(F)(F)F)=O)=O |