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N-(L-VALINE)-3,5-DIBROMO-SALICYLALDEHYDE-TETRABUTYLAMMONIUM-SALT

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N-(L-VALINE)-3,5-DIBROMO-SALICYLALDEHYDE-TETRABUTYLAMMONIUM-SALT
SpectraBase Compound ID AILwpttpr6d
InChI InChI=1S/C17H38N.C12H13Br2NO3/c1-5-9-13-17-18(14-10-6-2,15-11-7-3)16-12-8-4;1-6(2)10(12(17)18)15-5-7-3-8(13)4-9(14)11(7)16/h5-17H2,1-4H3;3-6,10,16H,1-2H3,(H,17,18)/q+1;/p-1/b;15-5+/t;10-/m.0/s1
InChIKey WMURHFJRTMLILG-UIXACTAISA-M
Mol Weight 634.54 g/mol
Molecular Formula C29H50Br2N2O3
Exact Mass 632.218819 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID A7wyroHpdc1
Name N-(L-VALINE)-3,5-DIBROMO-SALICYLALDEHYDE-TETRABUTYLAMMONIUM-SALT
Compound Number 11
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C29H50Br2N2O3
InChI InChI=1S/C17H38N.C12H13Br2NO3/c1-5-9-13-17-18(14-10-6-2,15-11-7-3)16-12-8-4;1-6(2)10(12(17)18)15-5-7-3-8(13)4-9(14)11(7)16/h5-17H2,1-4H3;3-6,10,16H,1-2H3,(H,17,18)/q+1;/p-1/b;15-5+/t;10-/m.0/s1
InChIKey WMURHFJRTMLILG-UIXACTAISA-M
Literature Reference Author Z.ROZWADOWSKI
Literature Reference Citation MAGN.RES.CHEM.,44,881(2006)
Literature Reference DOI 10.1002/mrc.1852
Molecular Weight 634.536 g/mol
Sample ID 63402
Solvent CDCl3