| SpectraBase Compound ID | ES0AozAbbml |
|---|---|
| InChI | InChI=1S/C10H9F7N2/c11-8(12,9(13,14)10(15,16)17)7-5-3-1-2-4-6(5)18-19-7/h1-4H2,(H,18,19) |
| InChIKey | UMUZULHRVCJDJS-UHFFFAOYSA-N |
| Mol Weight | 290.18 g/mol |
| Molecular Formula | C10H9F7N2 |
| Exact Mass | 290.065395 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FD3wj3TXj6Z |
|---|---|
| Name | 3-Heptafluoropropyl-4,5,6,7-tetrahydroindazole |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 290.065395439 u |
| Formula | C10H9F7N2 |
| InChI | InChI=1S/C10H9F7N2/c11-8(12,9(13,14)10(15,16)17)7-5-3-1-2-4-6(5)18-19-7/h1-4H2,(H,18,19) |
| InChIKey | UMUZULHRVCJDJS-UHFFFAOYSA-N |
| Molecular Weight | 290.185 g/mol |
| SMILES | C1(=NNC=2CCCCC12)C(F)(F)C(F)(F)C(F)(F)F |