| SpectraBase Compound ID | GoQbRNVAqsW |
|---|---|
| InChI | InChI=1S/C10H10F3NO/c1-7(15)14-6-8-2-4-9(5-3-8)10(11,12)13/h2-5H,6H2,1H3,(H,14,15) |
| InChIKey | JBFAQRBRZBMFKY-UHFFFAOYSA-N |
| Mol Weight | 217.19 g/mol |
| Molecular Formula | C10H10F3NO |
| Exact Mass | 217.071448 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3s7py2mOSoi |
|---|---|
| Name | 4-(Trifluoromethyl)benzylamine, N-acetyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 217.071448434 u |
| Formula | C10H10F3NO |
| InChI | InChI=1S/C10H10F3NO/c1-7(15)14-6-8-2-4-9(5-3-8)10(11,12)13/h2-5H,6H2,1H3,(H,14,15) |
| InChIKey | JBFAQRBRZBMFKY-UHFFFAOYSA-N |
| Molecular Weight | 217.191 g/mol |
| SMILES | C1=C(C=CC(=C1)CNC(C)=O)C(F)(F)F |