| SpectraBase Compound ID | 9MwUbYeNeMu |
|---|---|
| InChI | InChI=1S/C13H5ClF5NO/c14-5-2-1-3-6(4-5)20-13(21)7-8(15)10(17)12(19)11(18)9(7)16/h1-4H,(H,20,21) |
| InChIKey | GZUHDNOIYISDGC-UHFFFAOYSA-N |
| Mol Weight | 321.63 g/mol |
| Molecular Formula | C13H5ClF5NO |
| Exact Mass | 320.997982 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7faRLCtDYvJ |
|---|---|
| Name | Benzamide, N-(3-chlorophenyl)-2,3,4,5,6-pentafluoro- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 320.997982299 u |
| Formula | C13H5ClF5NO |
| InChI | InChI=1S/C13H5ClF5NO/c14-5-2-1-3-6(4-5)20-13(21)7-8(15)10(17)12(19)11(18)9(7)16/h1-4H,(H,20,21) |
| InChIKey | GZUHDNOIYISDGC-UHFFFAOYSA-N |
| Molecular Weight | 321.634 g/mol |
| SMILES | C1(=C(C(=C(C(=C1F)F)C(NC1=CC=CC(=C1)Cl)=O)F)F)F |