| SpectraBase Compound ID | IuRwsRXlPfN |
|---|---|
| InChI | InChI=1S/C20H24F3NO3/c1-25-17-6-4-14(5-7-17)13-24-9-8-15-10-19(27-3)16(11-18(15)26-2)12-20(21,22)23/h4-7,10-11,24H,8-9,12-13H2,1-3H3 |
| InChIKey | IBFJIQUDLXCZGL-UHFFFAOYSA-N |
| Mol Weight | 383.41 g/mol |
| Molecular Formula | C20H24F3NO3 |
| Exact Mass | 383.170828 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9vUu1Z6dFZK |
|---|---|
| Name | 2C-tfe N-(4-Methoxybenzyl) |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 383.170828123 u |
| Formula | C20H24F3NO3 |
| InChI | InChI=1S/C20H24F3NO3/c1-25-17-6-4-14(5-7-17)13-24-9-8-15-10-19(27-3)16(11-18(15)26-2)12-20(21,22)23/h4-7,10-11,24H,8-9,12-13H2,1-3H3 |
| InChIKey | IBFJIQUDLXCZGL-UHFFFAOYSA-N |
| Molecular Weight | 383.411 g/mol |
| SMILES | C1(=C(C=C(C(=C1)CCNCC=1C=CC(=CC1)OC)OC)CC(F)(F)F)OC |