| SpectraBase Compound ID | AqCJSoyQqNy |
|---|---|
| InChI | InChI=1S/C34H43F12N2O4PS2/c1-29(2,3)27(47-54(49,50)25-14-20(31(35,36)37)12-21(15-25)32(38,39)40)18-53(24-10-8-7-9-11-24)19-28(30(4,5)6)48-55(51,52)26-16-22(33(41,42)43)13-23(17-26)34(44,45)46/h12-17,24,27-28,47-48H,7-11,18-19H2,1-6H3/t27-,28-/m1/s1 |
| InChIKey | YYPQPALVMCBPML-VSGBNLITSA-N |
| Mol Weight | 866.8 g/mol |
| Molecular Formula | C34H43F12N2O4PS2 |
| Exact Mass | 866.221025 g/mol |
19F Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DG05n7x3709 |
|---|---|
| Name | YYPQPALVMCBPML-VSGBNLITSA-N |
| Compound Number | 6 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C34H43F12N2O4PS2 |
| InChI | InChI=1S/C34H43F12N2O4PS2/c1-29(2,3)27(47-54(49,50)25-14-20(31(35,36)37)12-21(15-25)32(38,39)40)18-53(24-10-8-7-9-11-24)19-28(30(4,5)6)48-55(51,52)26-16-22(33(41,42)43)13-23(17-26)34(44,45)46/h12-17,24,27-28,47-48H,7-11,18-19H2,1-6H3/t27-,28-/m1/s1 |
| InChIKey | YYPQPALVMCBPML-VSGBNLITSA-N |
| Literature Reference Author | A.P.DUNCAN,J.L.LEIGHTON |
| Literature Reference Citation | ORG.LETTERS,6,4117(2004) |
| Literature Reference DOI | 10.1021/ol048191o |
| Solvent | CDCl3 |
| Source File Reference | UWLU50166 |