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2-[[2,4,4,6,6-penta(pyrazol-1-yl)-1,3,5-triaza-2$l^{5},4$l^{5},6$l^{5}-triphosphacyclohexa-1,3,5-trien-2-yl]amino]-2-phenyl-acetic acid ethyl ester
SpectraBase Compound ID 39p9Zhwv8BK
InChI InChI=1S/C25H27N14O2P3/c1-2-41-25(40)24(23-11-4-3-5-12-23)31-42(35-18-6-13-26-35)32-43(36-19-7-14-27-36,37-20-8-15-28-37)34-44(33-42,38-21-9-16-29-38)39-22-10-17-30-39/h3-22,24,31H,2H2,1H3
InChIKey JJFZYGZJAJZKFB-UHFFFAOYSA-N
Mol Weight 648.51 g/mol
Molecular Formula C25H27N14O2P3
Exact Mass 648.165427 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID D0mjJE30QdM
Name 2-[[2,4,4,6,6-penta(pyrazol-1-yl)-1,3,5-triaza-2$l^{5},4$l^{5},6$l^{5}-triphosphacyclohexa-1,3,5-trien-2-yl]amino]-2-phenyl-acetic acid ethyl ester
Compound Number 16
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H27N14O2P3
InChI InChI=1S/C25H27N14O2P3/c1-2-41-25(40)24(23-11-4-3-5-12-23)31-42(35-18-6-13-26-35)32-43(36-19-7-14-27-36,37-20-8-15-28-37)34-44(33-42,38-21-9-16-29-38)39-22-10-17-30-39/h3-22,24,31H,2H2,1H3
InChIKey JJFZYGZJAJZKFB-UHFFFAOYSA-N
Literature Reference Author V.VICENTE,A.FRUCHIER,H.J.CRISTAU
Literature Reference Citation MAGN.RES.CHEM.,41,183(2003)
Literature Reference DOI 10.1002/mrc.1155
Solvent CDCl3
Source File Reference UWMZ20050