| SpectraBase Compound ID | Fzyo3ZHJXcQ |
|---|---|
| InChI | InChI=1S/C26H7F35O11/c27-12(28,17(37,38)22(47,48)49)7(62)67-1-2(68-8(63)13(29,30)18(39,40)23(50,51)52)3-4(70-9(64)14(31,32)19(41,42)24(53,54)55)5(71-10(65)15(33,34)20(43,44)25(56,57)58)6(69-3)72-11(66)16(35,36)21(45,46)26(59,60)61/h2-6H,1H2 |
| InChIKey | BHNPBEWXVMTILX-UHFFFAOYSA-N |
| Mol Weight | 1160.28 g/mol |
| Molecular Formula | C26H7F35O11 |
| Exact Mass | 1159.942947 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DC2kiupvEzh |
|---|---|
| Name | Chloralose-m/artifact 5hfb P1735 |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 1159.942946739 u |
| Formula | C26H7F35O11 |
| InChI | InChI=1S/C26H7F35O11/c27-12(28,17(37,38)22(47,48)49)7(62)67-1-2(68-8(63)13(29,30)18(39,40)23(50,51)52)3-4(70-9(64)14(31,32)19(41,42)24(53,54)55)5(71-10(65)15(33,34)20(43,44)25(56,57)58)6(69-3)72-11(66)16(35,36)21(45,46)26(59,60)61/h2-6H,1H2 |
| InChIKey | BHNPBEWXVMTILX-UHFFFAOYSA-N |
| Molecular Weight | 1160.275 g/mol |
| SMILES | C(C(OC1C(OC(=O)C(C(C(F)(F)F)(F)F)(F)F)C(C(OC(=O)C(F)(F)C(C(F)(F)F)(F)F)COC(=O)C(F)(F)C(C(F)(F)F)(F)F)OC1OC(=O)C(F)(C(C(F)(F)F)(F)F)F)=O)(F)(C(C(F)(F)F)(F)F)F |