| SpectraBase Compound ID | CaHyb679TKJ |
|---|---|
| InChI | InChI=1S/C15H10F5NO/c1-6-4-3-5-7(2)14(6)21-15(22)8-9(16)11(18)13(20)12(19)10(8)17/h3-5H,1-2H3,(H,21,22) |
| InChIKey | GWIDWSFXNXPEPG-UHFFFAOYSA-N |
| Mol Weight | 315.24 g/mol |
| Molecular Formula | C15H10F5NO |
| Exact Mass | 315.068255 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BwNYdQSJmYC |
|---|---|
| Name | N-(2,6-Dimethylphenyl)-2,3,4,5,6-pentafluoro-benzamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 315.068254760 u |
| Formula | C15H10F5NO |
| InChI | InChI=1S/C15H10F5NO/c1-6-4-3-5-7(2)14(6)21-15(22)8-9(16)11(18)13(20)12(19)10(8)17/h3-5H,1-2H3,(H,21,22) |
| InChIKey | GWIDWSFXNXPEPG-UHFFFAOYSA-N |
| Molecular Weight | 315.243 g/mol |
| SMILES | C=1(C(NC2=C(C=CC=C2C)C)=O)C(=C(F)C(=C(C1F)F)F)F |