| SpectraBase Compound ID | GTlmS0AnRzI |
|---|---|
| InChI | InChI=1S/C11H12F3NO/c1-8(16)15-7-6-9-2-4-10(5-3-9)11(12,13)14/h2-5H,6-7H2,1H3,(H,15,16) |
| InChIKey | TYJGVPBXNRCDBD-UHFFFAOYSA-N |
| Mol Weight | 231.22 g/mol |
| Molecular Formula | C11H12F3NO |
| Exact Mass | 231.087098 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1TR9ZFhkjom |
|---|---|
| Name | 2-(4-Trifluoromethylphenyl)ethylamine, ac derivative |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 231.087098498 u |
| Formula | C11H12F3NO |
| InChI | InChI=1S/C11H12F3NO/c1-8(16)15-7-6-9-2-4-10(5-3-9)11(12,13)14/h2-5H,6-7H2,1H3,(H,15,16) |
| InChIKey | TYJGVPBXNRCDBD-UHFFFAOYSA-N |
| Molecular Weight | 231.218 g/mol |
| SMILES | C(F)(F)(F)C1=CC=C(C=C1)CCNC(C)=O |