| SpectraBase Compound ID | 7DtZm90yGHb |
|---|---|
| InChI | InChI=1S/C14H15N.C2HF3O2/c1-3-7-13(8-4-1)11-15-12-14-9-5-2-6-10-14;3-2(4,5)1(6)7/h1-10,15H,11-12H2;(H,6,7) |
| InChIKey | RGGPDHHEMZDRQW-UHFFFAOYSA-N |
| Mol Weight | 311.3 g/mol |
| Molecular Formula | C16H16F3NO2 |
| Exact Mass | 311.113313 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 | EXB2VauuJ0F |
|---|---|
| Name | Dibenzylamonium trifluoroacetate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 311.113313246 u |
| Formula | C16H16F3NO2 |
| InChI | InChI=1S/C14H15N.C2HF3O2/c1-3-7-13(8-4-1)11-15-12-14-9-5-2-6-10-14;3-2(4,5)1(6)7/h1-10,15H,11-12H2;(H,6,7) |
| InChIKey | RGGPDHHEMZDRQW-UHFFFAOYSA-N |
| Molecular Weight | 311.304 g/mol |
| SMILES | C(C(F)(F)F)(=O)O.C=1C=CC(CNCC2=CC=CC=C2)=CC1 |