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UERZADBTHDKLHF-UHFFFAOYSA-N

View entire compound with spectra: 1 NMR

UERZADBTHDKLHF-UHFFFAOYSA-N
SpectraBase Compound ID 6UbZQj7QaC9
InChI InChI=1S/C24BF20.C13H19N2.C8H11N.C4H9.Al/c26-5-1(6(27)14(35)21(42)13(5)34)25(2-7(28)15(36)22(43)16(37)8(2)29,3-9(30)17(38)23(44)18(39)10(3)31)4-11(32)19(40)24(45)20(41)12(4)33;1-10(2)14-12-8-6-5-7-9-13(12)15-11(3)4;1-9(2)8-6-4-3-5-7-8;1-4(2)3;/h;5-11H,1-4H3;3-7H,1-2H3;4H,1H2,2-3H3;/q2*-1;;;+2
InChIKey UERZADBTHDKLHF-UHFFFAOYSA-N
Mol Weight 1087.6 g/mol
Molecular Formula C49H39AlBF20N3
Exact Mass 1087.273305 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID NmxT6KRTkO
Name UERZADBTHDKLHF-UHFFFAOYSA-N
Compound Number 7E
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C49H39AlBF20N3
InChI InChI=1S/C24BF20.C13H19N2.C8H11N.C4H9.Al/c26-5-1(6(27)14(35)21(42)13(5)34)25(2-7(28)15(36)22(43)16(37)8(2)29,3-9(30)17(38)23(44)18(39)10(3)31)4-11(32)19(40)24(45)20(41)12(4)33;1-10(2)14-12-8-6-5-7-9-13(12)15-11(3)4;1-9(2)8-6-4-3-5-7-8;1-4(2)3;/h;5-11H,1-4H3;3-7H,1-2H3;4H,1H2,2-3H3;/q2*-1;;;+2
InChIKey UERZADBTHDKLHF-UHFFFAOYSA-N
Literature Reference Author A.V.KOROLEV,E.IHARA,I.A.GUZEI,V.G.YOUNG,R.F.JORDAN
Literature Reference Citation J.AM.CHEM.SOC.,123,8291(2001)
Literature Reference DOI 10.1021/ja010242e
Molecular Weight 1087.628 g/mol
Solvent C6D5Cl
Source File Reference UWLU33191