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1-(4-(TERT.-BUTYL)-1H-1,2,3-TRIAZOL-1-YL)-3-(DIETHOXYPHOSPHORYL)-PROPAN-2-YL-4-METHOXYBENZOATE
SpectraBase Compound ID 5vp6ntzdJ6c
InChI InChI=1S/C21H32N3O6P/c1-7-28-31(26,29-8-2)15-18(13-24-14-19(22-23-24)21(3,4)5)30-20(25)16-9-11-17(27-6)12-10-16/h9-12,14,18H,7-8,13,15H2,1-6H3
InChIKey XXNHEFWTSVWLGG-UHFFFAOYSA-N
Mol Weight 453.5 g/mol
Molecular Formula C21H32N3O6P
Exact Mass 453.202873 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KnjytsJx53y
Name 1-(4-(TERT.-BUTYL)-1H-1,2,3-TRIAZOL-1-YL)-3-(DIETHOXYPHOSPHORYL)-PROPAN-2-YL-4-METHOXYBENZOATE
Compound Number 5 -C6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H32N3O6P
InChI InChI=1S/C21H32N3O6P/c1-7-28-31(26,29-8-2)15-18(13-24-14-19(22-23-24)21(3,4)5)30-20(25)16-9-11-17(27-6)12-10-16/h9-12,14,18H,7-8,13,15H2,1-6H3
InChIKey XXNHEFWTSVWLGG-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 UWPA2298