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[(DAD)-PD-[CH2CHMECH2OET]]-[BAR-(4)]
SpectraBase Compound ID 2UTcBlo3Z4x
InChI InChI=1S/C32H12BF24.C28H40N2.C6H13O.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;1-17(2)23-13-11-14-24(18(3)4)27(23)29-21(9)22(10)30-28-25(19(5)6)15-12-16-26(28)20(7)8;1-4-7-5-6(2)3;/h1-12H;11-20H,1-10H3;6H,2,4-5H2,1,3H3;/q-1;;;+1
InChIKey SJRZYNAPPXYLMS-UHFFFAOYSA-N
Mol Weight 1475.5 g/mol
Molecular Formula C66H65BF24N2OPd
Exact Mass 1474.384151 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID UXCTZjAZEw
Name [(DAD)-PD-[CH2CHMECH2OET]]-[BAR-(4)]
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C66H65BF24N2OPd
InChI InChI=1S/C32H12BF24.C28H40N2.C6H13O.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;1-17(2)23-13-11-14-24(18(3)4)27(23)29-21(9)22(10)30-28-25(19(5)6)15-12-16-26(28)20(7)8;1-4-7-5-6(2)3;/h1-12H;11-20H,1-10H3;6H,2,4-5H2,1,3H3;/q-1;;;+1
InChIKey SJRZYNAPPXYLMS-UHFFFAOYSA-N
Literature Reference Author W.LI,X.ZHANG,A.MEETSMA,B.HESSEN
Literature Reference Citation J.AM.CHEM.SOC.,126,12246(2004)
Literature Reference DOI 10.1021/ja045948y
Molecular Weight 1475.447 g/mol
Solvent CD2Cl2
Source File Reference UWVN31635