| SpectraBase Compound ID | 2mjC9lD7lYu |
|---|---|
| InChI | InChI=1S/C9H8F3N/c10-9(11,12)7-13-6-8-4-2-1-3-5-8/h1-6H,7H2/b13-6+ |
| InChIKey | GSIRPSHHCYBHAS-AWNIVKPZSA-N |
| Mol Weight | 187.17 g/mol |
| Molecular Formula | C9H8F3N |
| Exact Mass | 187.060884 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | mjMZJmYT1o |
|---|---|
| Name | N-Benzylidene-2,2,2-trifluoroethylamine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 187.060883751 u |
| Formula | C9H8F3N |
| InChI | InChI=1S/C9H8F3N/c10-9(11,12)7-13-6-8-4-2-1-3-5-8/h1-6H,7H2/b13-6+ |
| InChIKey | GSIRPSHHCYBHAS-AWNIVKPZSA-N |
| Molecular Weight | 187.165 g/mol |
| SMILES | C(F)(F)(F)C\N=C\C=1C=CC=CC1 |