| SpectraBase Compound ID | JxycO6hCR4G |
|---|---|
| InChI | InChI=1S/C12H16F3N/c1-3-9(2)16-8-10-5-4-6-11(7-10)12(13,14)15/h4-7,9,16H,3,8H2,1-2H3 |
| InChIKey | LMWYNHAHFWCESF-UHFFFAOYSA-N |
| Mol Weight | 231.26 g/mol |
| Molecular Formula | C12H16F3N |
| Exact Mass | 231.123484 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | F2AfDr2jbjG |
|---|---|
| Name | N-2-Butyl-3-(trifluoromethyl)benzylamine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 231.123484008 u |
| Formula | C12H16F3N |
| InChI | InChI=1S/C12H16F3N/c1-3-9(2)16-8-10-5-4-6-11(7-10)12(13,14)15/h4-7,9,16H,3,8H2,1-2H3 |
| InChIKey | LMWYNHAHFWCESF-UHFFFAOYSA-N |
| Molecular Weight | 231.262 g/mol |
| SMILES | C(C1=CC(CNC(CC)C)=CC=C1)(F)(F)F |