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(4S,5S)-N,N'-DIMETHYL-N,N,N',N'-TETRAKIS-[(4-METHYLPHENYL)-METHYL]-2,2-DIPROPYL-1,3-DIOXOLANE-4,5-DIMETHANAMINIUM-DITETRAFLUOROBORATE

View entire compound with spectra: 1 NMR

(4S,5S)-N,N'-DIMETHYL-N,N,N',N'-TETRAKIS-[(4-METHYLPHENYL)-METHYL]-2,2-DIPROPYL-1,3-DIOXOLANE-4,5-DIMETHANAMINIUM-DITETRAFLUOROBORATE
SpectraBase Compound ID HHBUNUq2N2D
InChI InChI=1S/C45H62N2O2.2BF4/c1-9-27-45(28-10-2)48-43(33-46(7,29-39-19-11-35(3)12-20-39)30-40-21-13-36(4)14-22-40)44(49-45)34-47(8,31-41-23-15-37(5)16-24-41)32-42-25-17-38(6)18-26-42;2*2-1(3,4)5/h11-26,43-44H,9-10,27-34H2,1-8H3;;/q+2;2*-1/t43-,44-;;/m0../s1
InChIKey FYRYSIHUMABZFG-OWRGXFNZSA-N
Mol Weight 836.6 g/mol
Molecular Formula C45H62B2F8N2O2
Exact Mass 836.486965 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LTZKYqqqWUT
Name (4S,5S)-N,N'-DIMETHYL-N,N,N',N'-TETRAKIS-[(4-METHYLPHENYL)-METHYL]-2,2-DIPROPYL-1,3-DIOXOLANE-4,5-DIMETHANAMINIUM-DITETRAFLUOROBORATE
Compound Number 2D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C45H62B2F8N2O2
InChI InChI=1S/C45H62N2O2.2BF4/c1-9-27-45(28-10-2)48-43(33-46(7,29-39-19-11-35(3)12-20-39)30-40-21-13-36(4)14-22-40)44(49-45)34-47(8,31-41-23-15-37(5)16-24-41)32-42-25-17-38(6)18-26-42;2*2-1(3,4)5/h11-26,43-44H,9-10,27-34H2,1-8H3;;/q+2;2*-1/t43-,44-;;/m0../s1
InChIKey FYRYSIHUMABZFG-OWRGXFNZSA-N
Literature Reference Author T.OHSHIMA.V.GNANADESIKAN,T.SHIBUGUCHHI,Y.FUKUTA,T.NEMOTO,M.S HIBASAKI
Literature Reference Citation J.AM.CHEM.SOC.,125,11206(2003)
Literature Reference DOI 10.1021/ja037290e
Molecular Weight 836.607 g/mol
Sample ID 50496
Solvent CDCl3