![2-[Trifluoroacetamido-nh-L-tryptophanamido-(2-ethoxy)]-ethanol](/api/spectrum/FpoW5ORvxd5/structure.png?h=300&w=458 "2-[Trifluoroacetamido-nh-L-tryptophanamido-(2-ethoxy)]-ethanol")
| SpectraBase Compound ID | sVWILyHi2R |
|---|---|
| InChI | InChI=1S/C17H20F3N3O4/c18-17(19,20)16(26)23-14(15(25)21-5-7-27-8-6-24)9-11-10-22-13-4-2-1-3-12(11)13/h1-4,10,14,22,24H,5-9H2,(H,21,25)(H,23,26)/t14-/m0/s1 |
| InChIKey | FWXCQCVLRWTPRM-AWEZNQCLSA-N |
| Mol Weight | 387.36 g/mol |
| Molecular Formula | C17H20F3N3O4 |
| Exact Mass | 387.140591 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FpoW5ORvxd5 |
|---|---|
| Name | 2-[Trifluoroacetamido-nh-L-tryptophanamido-(2-ethoxy)]-ethanol |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 387.140590621 u |
| Formula | C17H20F3N3O4 |
| InChI | InChI=1S/C17H20F3N3O4/c18-17(19,20)16(26)23-14(15(25)21-5-7-27-8-6-24)9-11-10-22-13-4-2-1-3-12(11)13/h1-4,10,14,22,24H,5-9H2,(H,21,25)(H,23,26)/t14-/m0/s1 |
| InChIKey | FWXCQCVLRWTPRM-AWEZNQCLSA-N |
| Molecular Weight | 387.359 g/mol |
| SMILES | C=1NC2=CC=CC=C2C1C[C@](NC(=O)C(F)(F)F)(C(=O)NCCOCCO)[H] |