For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
[(C5H4-ME-ETA-5)2-ZR-(O-TERT.-BU)]-[B(C6F5)4]+VINYL-CHLORIDE
SpectraBase Compound ID KmEUaTwXBzX
InChI InChI=1S/C24BF20.2C6H3.C4H9O.C2HCl.Zr/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;2*1-6-4-2-3-5-6;1-4(2,3)5;1-2-3;/h;2*1H3;1-3H3;1H;/q-1;;;-1;;+2
InChIKey ROXMTKPQVSZJCK-UHFFFAOYSA-N
Mol Weight 1054.04 g/mol
Molecular Formula C42H16BClF20OZr
Exact Mass 1051.971035 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 92jqvLh0Qbv
Name [(C5H4-ME-ETA-5)2-ZR-(O-TERT.-BU)]-[B(C6F5)4]+VINYL-CHLORIDE
Compound Number 1+VINYL-CHLORIDE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C42H16BClF20OZr
InChI InChI=1S/C24BF20.2C6H3.C4H9O.C2HCl.Zr/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;2*1-6-4-2-3-5-6;1-4(2,3)5;1-2-3;/h;2*1H3;1-3H3;1H;/q-1;;;-1;;+2
InChIKey ROXMTKPQVSZJCK-UHFFFAOYSA-N
Literature Reference Author E.J.STOEBENAU,R.F.JORDAN
Literature Reference Citation J.AM.CHEM.SOC.,125,3222(2003)
Literature Reference DOI 10.1021/ja029963j
Molecular Weight 1054.040 g/mol
Sample ID 40784
Solvent CD2Cl2