| SpectraBase Compound ID | F2jgTI0tnV2 |
|---|---|
| InChI | InChI=1S/C21H7Cl2F15N2O3/c22-7-4-6(39-16(42)40-15(41)11-9(24)2-1-3-10(11)25)5-8(23)12(7)43-18(30,31)14(27)13(26)17(28,29)19(32,33)20(34,35)21(36,37)38/h1-5H,(H2,39,40,41,42)/b14-13+ |
| InChIKey | DFMJETWQNYZFLB-BUHFOSPRSA-N |
| Mol Weight | 691.18 g/mol |
| Molecular Formula | C21H7Cl2F15N2O3 |
| Exact Mass | 689.95942 g/mol |
19F Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8n7mkgEiej7 |
|---|---|
| Name | DFMJETWQNYZFLB-BUHFOSPRSA-N |
| Compound Number | 865 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C21H7Cl2F15N2O3 |
| InChI | InChI=1S/C21H7Cl2F15N2O3/c22-7-4-6(39-16(42)40-15(41)11-9(24)2-1-3-10(11)25)5-8(23)12(7)43-18(30,31)14(27)13(26)17(28,29)19(32,33)20(34,35)21(36,37)38/h1-5H,(H2,39,40,41,42)/b14-13+ |
| InChIKey | DFMJETWQNYZFLB-BUHFOSPRSA-N |
| Literature Reference Author | W.ROBIEN |
| Literature Reference Citation | W.ROBIEN,PRIVATE_COMMUNICATION |
| Solvent | DMSO-D6 |
| Source File Reference | WRPR1875 |