| SpectraBase Compound ID | 68ssVenJKgG |
|---|---|
| InChI | InChI=1S/C15H16F3NO2/c1-3-19(14(20)15(16,17)18)10(2)9-11-5-4-6-13-12(11)7-8-21-13/h4-8,10H,3,9H2,1-2H3 |
| InChIKey | JACQDSTYHVUDRD-UHFFFAOYSA-N |
| Mol Weight | 299.29 g/mol |
| Molecular Formula | C15H16F3NO2 |
| Exact Mass | 299.113313 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 79ENqjUsTJn |
|---|---|
| Name | 4-Eapb, N-trifluoroacetyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 299.113313246 u |
| Formula | C15H16F3NO2 |
| InChI | InChI=1S/C15H16F3NO2/c1-3-19(14(20)15(16,17)18)10(2)9-11-5-4-6-13-12(11)7-8-21-13/h4-8,10H,3,9H2,1-2H3 |
| InChIKey | JACQDSTYHVUDRD-UHFFFAOYSA-N |
| Molecular Weight | 299.293 g/mol |
| SMILES | C12=C(C(=CC=C2)CC(C)N(CC)C(C(F)(F)F)=O)C=CO1 |