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1-(DIETHOXYPHOSPHORYL)-3-(4-PHENYL-1H-1,2,3-TRIAZOL-1-YL)-PROPAN-2-YL-3,5-DINITROBENZOATE
SpectraBase Compound ID 5K0WaleP54O
InChI InChI=1S/C22H24N5O9P/c1-3-34-37(33,35-4-2)15-20(13-25-14-21(23-24-25)16-8-6-5-7-9-16)36-22(28)17-10-18(26(29)30)12-19(11-17)27(31)32/h5-12,14,20H,3-4,13,15H2,1-2H3
InChIKey QAPYVHGMVMLMMG-UHFFFAOYSA-N
Mol Weight 533.43 g/mol
Molecular Formula C22H24N5O9P
Exact Mass 533.131164 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4OX3jAU48Y1
Name 1-(DIETHOXYPHOSPHORYL)-3-(4-PHENYL-1H-1,2,3-TRIAZOL-1-YL)-PROPAN-2-YL-3,5-DINITROBENZOATE
Compound Number 5-A8
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H24N5O9P
InChI InChI=1S/C22H24N5O9P/c1-3-34-37(33,35-4-2)15-20(13-25-14-21(23-24-25)16-8-6-5-7-9-16)36-22(28)17-10-18(26(29)30)12-19(11-17)27(31)32/h5-12,14,20H,3-4,13,15H2,1-2H3
InChIKey QAPYVHGMVMLMMG-UHFFFAOYSA-N
Literature Reference Author Y.JIN,H.ZHAO,H.LU,C.M.KUEMMEL,J.ZHANG,D.WANG
Literature Reference Citation MOLECULES,20,1088(2015)
Literature Reference DOI 10.3390/molecules20011088
Solvent CDCl3
Source File Reference UWPA2284