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YKSQFNBXYLIYBJ-UHFFFAOYSA-N

View entire compound with spectra: 1 NMR

YKSQFNBXYLIYBJ-UHFFFAOYSA-N
SpectraBase Compound ID HyyDIzI06Xo
InChI InChI=1S/C24BF20.4C6H3.2CH3.CH2.2Zr/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;4*1-6-4-2-3-5-6;;;;;/h;4*1H3;2*1H3;1H2;;/q-1;;;;;;;;;+1
InChIKey YKSQFNBXYLIYBJ-UHFFFAOYSA-N
Mol Weight 1205.95 g/mol
Molecular Formula C51H20BF20Zr2
Exact Mass 1202.943267 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5rKaCnCtuCt
Name YKSQFNBXYLIYBJ-UHFFFAOYSA-N
Compound Number 3C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C51H20BF20Zr2
InChI InChI=1S/C24BF20.4C6H3.2CH3.CH2.2Zr/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;4*1-6-4-2-3-5-6;;;;;/h;4*1H3;2*1H3;1H2;;/q-1;;;;;;;;;+1
InChIKey YKSQFNBXYLIYBJ-UHFFFAOYSA-N
Literature Reference Author F.WU,A.K.DASH,R.F.JORDAN
Literature Reference Citation J.AM.CHEM.SOC.,126,15360(2004)
Literature Reference DOI 10.1021/ja044303v
Molecular Weight 1205.938 g/mol
Solvent C6D5Cl
Source File Reference UWLU34933