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KXVBXIQCTVHAQT-UHFFFAOYSA-N

View entire compound with spectra: 1 NMR

KXVBXIQCTVHAQT-UHFFFAOYSA-N
SpectraBase Compound ID FwnSMBCAsMg
InChI InChI=1S/C24BF20.2C8H8O2.3C4H9.Sn/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*1-10-8-5-3-2-4-7(8)6-9;3*1-3-4-2;/h;2*2-6H,1H3;3*1,3-4H2,2H3;/q-1;;;;;;+1
InChIKey KXVBXIQCTVHAQT-UHFFFAOYSA-N
Mol Weight 1241.4 g/mol
Molecular Formula C52H43BF20O4Sn
Exact Mass 1242.195705 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DKKpZIelRvB
Name KXVBXIQCTVHAQT-UHFFFAOYSA-N
Compound Number O,O-5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C52H43BF20O4Sn
InChI InChI=1S/C24BF20.2C8H8O2.3C4H9.Sn/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*1-10-8-5-3-2-4-7(8)6-9;3*1-3-4-2;/h;2*2-6H,1H3;3*1,3-4H2,2H3;/q-1;;;;;;+1
InChIKey KXVBXIQCTVHAQT-UHFFFAOYSA-N
Literature Reference Author J.M.BLACKWELL,W.E.PIERS,R.MCDONALD
Literature Reference Citation J.AM.CHEM.SOC.,124,1295(2002)
Literature Reference DOI 10.1021/ja012028w
Molecular Weight 1241.379 g/mol
Sample ID 47730
Solvent CD2Cl2