| SpectraBase Compound ID | EIe8Mc7H0z5 |
|---|---|
| InChI | InChI=1S/C26H21F23O6S/c1-13-4-6-14(7-5-13)56(51,52)54-12-15(2,10-50)11-53-9-3-8-16(27,28)17(29,30)18(31,32)19(33,34)20(35,36)21(37,38)22(39,40)26(48,49)55-23(41,24(42,43)44)25(45,46)47/h3-8,50H,9-12H2,1-2H3/b8-3+/t15-/m0/s1 |
| InChIKey | OMZMOWRMWRJXEU-GZTQLTBSSA-N |
| Mol Weight | 898.47 g/mol |
| Molecular Formula | C26H21F23O6S |
| Exact Mass | 898.069157 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4AEuBr6gwA |
|---|---|
| Name | OMZMOWRMWRJXEU-GZTQLTBSSA-N |
| Compound Number | 14 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C26H21F23O6S |
| InChI | InChI=1S/C26H21F23O6S/c1-13-4-6-14(7-5-13)56(51,52)54-12-15(2,10-50)11-53-9-3-8-16(27,28)17(29,30)18(31,32)19(33,34)20(35,36)21(37,38)22(39,40)26(48,49)55-23(41,24(42,43)44)25(45,46)47/h3-8,50H,9-12H2,1-2H3/b8-3+/t15-/m0/s1 |
| InChIKey | OMZMOWRMWRJXEU-GZTQLTBSSA-N |
| Literature Reference Author | B.A.OMOTOWA,M.R.JUDD,B.TWAMLEY,J.M.SHREEVE |
| Literature Reference Citation | J.ORG.CHEM.,67,1588(2002) |
| Literature Reference DOI | 10.1021/jo016166f |
| Molecular Weight | 898.472 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWMS23385 |