| SpectraBase Compound ID | 2A9yeLVd3zW |
|---|---|
| InChI | InChI=1S/C12H14F3NO/c1-2-3-9-16(11(17)12(13,14)15)10-7-5-4-6-8-10/h4-8H,2-3,9H2,1H3 |
| InChIKey | NPRVYZWJDSWWJG-UHFFFAOYSA-N |
| Mol Weight | 245.25 g/mol |
| Molecular Formula | C12H14F3NO |
| Exact Mass | 245.102749 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6Qgwa8vRpmS |
|---|---|
| Name | Trifluoroacetamide, N-butyl-N-phenyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 245.102748563 u |
| Formula | C12H14F3NO |
| InChI | InChI=1S/C12H14F3NO/c1-2-3-9-16(11(17)12(13,14)15)10-7-5-4-6-8-10/h4-8H,2-3,9H2,1H3 |
| InChIKey | NPRVYZWJDSWWJG-UHFFFAOYSA-N |
| Molecular Weight | 245.245 g/mol |
| SMILES | C1=CC=CC(=C1)N(CCCC)C(C(F)(F)F)=O |