| SpectraBase Compound ID | 8smGkX2CDDd |
|---|---|
| InChI | InChI=1S/C23H21F7N2O2/c1-14-4-3-5-15(10-14)13-32(20(33)21(24,25)22(26,27)23(28,29)30)9-8-16-12-31-19-7-6-17(34-2)11-18(16)19/h3-7,10-12,31H,8-9,13H2,1-2H3 |
| InChIKey | LAMDUIXFDRLNKF-UHFFFAOYSA-N |
| Mol Weight | 490.42 g/mol |
| Molecular Formula | C23H21F7N2O2 |
| Exact Mass | 490.149125 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
Subscribe to view the full spectrum.
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | Ig7jizLCK3l |
|---|---|
| Name | 5mt-Nb3Me hfb P1648 |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 490.149125063 u |
| Formula | C23H21F7N2O2 |
| InChI | InChI=1S/C23H21F7N2O2/c1-14-4-3-5-15(10-14)13-32(20(33)21(24,25)22(26,27)23(28,29)30)9-8-16-12-31-19-7-6-17(34-2)11-18(16)19/h3-7,10-12,31H,8-9,13H2,1-2H3 |
| InChIKey | LAMDUIXFDRLNKF-UHFFFAOYSA-N |
| Molecular Weight | 490.422 g/mol |
| SMILES | C1(=CC=C2C(=C1)C(=CN2)CCN(C(=O)C(F)(F)C(F)(F)C(F)(F)F)CC1=CC(=CC=C1)C)OC |