![[(2,2-BIS-[2-[4-(S)-METHYL-1,3-OXAZOLINYL]]-PROPANE)-PD-(C(O)CH3)(CO)](+)-[BAR'4](-)](/api/spectrum/6RHAIjbhLRn/structure.png?h=300&w=458 "[(2,2-BIS-[2-[4-(S)-METHYL-1,3-OXAZOLINYL]]-PROPANE)-PD-(C(O)CH3)(CO)](+)-[BAR'4](-)")
| SpectraBase Compound ID | JojM3tx5YkJ |
|---|---|
| InChI | InChI=1S/C32H12BF24.C11H18N2O2.C2H3O.CO.Pd/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;1-7-5-14-9(12-7)11(3,4)10-13-8(2)6-15-10;1-2-3;1-2;/h1-12H;7-8H,5-6H2,1-4H3;1H3;;/q-1;;;;+1/t;7-,8-;;;/m.0.../s1 |
| InChIKey | OSSQVFBAWRVEFK-CFSBSTNESA-N |
| Mol Weight | 1250.97 g/mol |
| Molecular Formula | C46H33BF24N2O4Pd |
| Exact Mass | 1250.118494 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6RHAIjbhLRn |
|---|---|
| Name | [(2,2-BIS-[2-[4-(S)-METHYL-1,3-OXAZOLINYL]]-PROPANE)-PD-(C(O)CH3)(CO)](+)-[BAR'4](-) |
| Compound Number | 12 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C46H33BF24N2O4Pd |
| InChI | InChI=1S/C32H12BF24.C11H18N2O2.C2H3O.CO.Pd/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;1-7-5-14-9(12-7)11(3,4)10-13-8(2)6-15-10;1-2-3;1-2;/h1-12H;7-8H,5-6H2,1-4H3;1H3;;/q-1;;;;+1/t;7-,8-;;;/m.0.../s1 |
| InChIKey | OSSQVFBAWRVEFK-CFSBSTNESA-N |
| Literature Reference Author | M.BROOKHART,M.I.WAGNER |
| Literature Reference Citation | J.AM.CHEM.SOC.,118,7219(1996) |
| Literature Reference DOI | 10.1021/ja9610141 |
| Molecular Weight | 1250.971 g/mol |
| Sample ID | 36031 |
| Solvent | CD2Cl2 |