| SpectraBase Compound ID | LyYHM49B2UT |
|---|---|
| InChI | InChI=1S/C32H12BF24.C27H31N2P.C8H8.Ir/c34-25(35,36)13-1-14(26(37,38)39)6-21(5-13)33(22-7-15(27(40,41)42)2-16(8-22)28(43,44)45,23-9-17(29(46,47)48)3-18(10-23)30(49,50)51)24-11-19(31(52,53)54)4-20(12-24)32(55,56)57;1-20(2)25-19-29(21(3)4)27(28-25)24-17-11-12-18-26(24)30(22-13-7-5-8-14-22)23-15-9-6-10-16-23;1-2-4-6-8-7-5-3-1;/h1-12H;5-18,20-21,25H,19H2,1-4H3;1-2,7-8H2;/q-1;;;/p+1/t;25-;;/m.1../s1 |
| InChIKey | WSNWAHBRKICHCJ-NXVRCFTKSA-O |
| Mol Weight | 1575.1 g/mol |
| Molecular Formula | C67H52BF24IrN2P |
| Exact Mass | 1575.320717 g/mol |
31P Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DD8WJ3v62e6 |
|---|---|
| Name | WSNWAHBRKICHCJ-NXVRCFTKSA-O |
| Compound Number | 1A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C67H51BF24IrN2P |
| InChI | InChI=1S/C32H12BF24.C27H31N2P.C8H8.Ir/c34-25(35,36)13-1-14(26(37,38)39)6-21(5-13)33(22-7-15(27(40,41)42)2-16(8-22)28(43,44)45,23-9-17(29(46,47)48)3-18(10-23)30(49,50)51)24-11-19(31(52,53)54)4-20(12-24)32(55,56)57;1-20(2)25-19-29(21(3)4)27(28-25)24-17-11-12-18-26(24)30(22-13-7-5-8-14-22)23-15-9-6-10-16-23;1-2-4-6-8-7-5-3-1;/h1-12H;5-18,20-21,25H,19H2,1-4H3;1-2,7-8H2;/q-1;;;/p+1/t;25-;;/m.1../s1 |
| InChIKey | WSNWAHBRKICHCJ-NXVRCFTKSA-O |
| Literature Reference Author | F.MENGES,M.NEUBURGER,A.PFALTZ |
| Literature Reference Citation | ORG.LETTERS,4,4713(2002) |
| Literature Reference DOI | 10.1021/ol027253c |
| Solvent | CDCl3 |
| Source File Reference | UWLU38013 |