| SpectraBase Compound ID | JNh5oJDuGgQ |
|---|---|
| InChI | InChI=1S/C9H6F3NO3/c10-9(11,12)8(14)13-5-1-2-6-7(3-5)16-4-15-6/h1-3H,4H2,(H,13,14) |
| InChIKey | FVXFPFROGMJLED-UHFFFAOYSA-N |
| Mol Weight | 233.15 g/mol |
| Molecular Formula | C9H6F3NO3 |
| Exact Mass | 233.029978 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JO87ajHRYw7 |
|---|---|
| Name | N-(2H-1,3-Benzodioxol-5-yl)-2,2,2-trifluoroacetamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 233.029977543 u |
| Formula | C9H6F3NO3 |
| InChI | InChI=1S/C9H6F3NO3/c10-9(11,12)8(14)13-5-1-2-6-7(3-5)16-4-15-6/h1-3H,4H2,(H,13,14) |
| InChIKey | FVXFPFROGMJLED-UHFFFAOYSA-N |
| Molecular Weight | 233.146 g/mol |
| SMILES | C12=CC(=CC=C2OCO1)NC(C(F)(F)F)=O |