| SpectraBase Compound ID | 8BLDHT1yp50 |
|---|---|
| InChI | InChI=1S/C10H8F3NO3/c1-17-7-4-2-3-6(5-7)8(15)14-9(16)10(11,12)13/h2-5H,1H3,(H,14,15,16) |
| InChIKey | XMCHGRQQMHOOQL-UHFFFAOYSA-N |
| Mol Weight | 247.17 g/mol |
| Molecular Formula | C10H8F3NO3 |
| Exact Mass | 247.045628 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 35lz8Bns7CP |
|---|---|
| Name | 3-Methoxybenzamide, N-trifluoroacetyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 247.045627608 u |
| Formula | C10H8F3NO3 |
| InChI | InChI=1S/C10H8F3NO3/c1-17-7-4-2-3-6(5-7)8(15)14-9(16)10(11,12)13/h2-5H,1H3,(H,14,15,16) |
| InChIKey | XMCHGRQQMHOOQL-UHFFFAOYSA-N |
| Molecular Weight | 247.173 g/mol |
| SMILES | C1(=CC=CC(=C1)C(NC(C(F)(F)F)=O)=O)OC |