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N-(L-PHENYLALANINE)-5-BROMO-SALICYLALDEHYDE-TETRABUTYLAMMONIUM-SALT

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N-(L-PHENYLALANINE)-5-BROMO-SALICYLALDEHYDE-TETRABUTYLAMMONIUM-SALT
SpectraBase Compound ID LSvvAH9spsc
InChI InChI=1S/C17H38N.C16H14BrNO3/c1-5-9-13-17-18(14-10-6-2,15-11-7-3)16-12-8-4;17-13-6-7-15(19)12(9-13)10-18-14(16(20)21)8-11-4-2-1-3-5-11/h5-17H2,1-4H3;1-7,9-10,14,19H,8H2,(H,20,21)/q+1;/p-1/b;18-10+/t;14-/m.0/s1
InChIKey IBVRPSXMALXWEE-ZZPKWCJTSA-M
Mol Weight 603.69 g/mol
Molecular Formula C33H51BrN2O3
Exact Mass 602.308307 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID D6LESSbA2dI
Name N-(L-PHENYLALANINE)-5-BROMO-SALICYLALDEHYDE-TETRABUTYLAMMONIUM-SALT
Compound Number 9
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C33H51BrN2O3
InChI InChI=1S/C17H38N.C16H14BrNO3/c1-5-9-13-17-18(14-10-6-2,15-11-7-3)16-12-8-4;17-13-6-7-15(19)12(9-13)10-18-14(16(20)21)8-11-4-2-1-3-5-11/h5-17H2,1-4H3;1-7,9-10,14,19H,8H2,(H,20,21)/q+1;/p-1/b;18-10+/t;14-/m.0/s1
InChIKey IBVRPSXMALXWEE-ZZPKWCJTSA-M
Literature Reference Author Z.ROZWADOWSKI
Literature Reference Citation MAGN.RES.CHEM.,44,881(2006)
Literature Reference DOI 10.1002/mrc.1852
Molecular Weight 603.684 g/mol
Sample ID 63394
Solvent CDCl3