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5-(AMINODIETHOXYPHOSPHONYLMETHYL)-25,27-DIPROPOXYCALIX-[4]-ARENE
SpectraBase Compound ID 7Ikwc3RdQht
InChI InChI=1S/C39H48NO7P/c1-7-44-48(43,45-8-2)39(40)34-22-32-20-30-16-10-14-28(37(30)46-24(3)4)18-26-12-9-13-27(35(26)41)19-29-15-11-17-31(38(29)47-25(5)6)21-33(23-34)36(32)42/h9-17,22-25,39,41-42H,7-8,18-21,40H2,1-6H3
InChIKey DNBHXLLGQHIBRU-UHFFFAOYSA-N
Mol Weight 673.8 g/mol
Molecular Formula C39H48NO7P
Exact Mass 673.31684 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ZA2MeZ0FZO
Name 5-(AMINODIETHOXYPHOSPHONYLMETHYL)-25,27-DIPROPOXYCALIX-[4]-ARENE
Compound Number 8
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C39H48NO7P
InChI InChI=1S/C39H48NO7P/c1-7-44-48(43,45-8-2)39(40)34-22-32-20-30-16-10-14-28(37(30)46-24(3)4)18-26-12-9-13-27(35(26)41)19-29-15-11-17-31(38(29)47-25(5)6)21-33(23-34)36(32)42/h9-17,22-25,39,41-42H,7-8,18-21,40H2,1-6H3
InChIKey DNBHXLLGQHIBRU-UHFFFAOYSA-N
Literature Reference Author S.CHERENOK,A.VOVK,I.MURAVYOVA,A.SHIVANYUK,V.KUKHAR,J.LIPKOWS KI,V.KALCHENKO
Literature Reference Citation ORG.LETTERS,8,549(2006)
Literature Reference DOI 10.1021/ol052469a
Solvent CDCl3
Source File Reference UWSI40206