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ISOMER-II

View entire compound with spectra: 4 NMR

ISOMER-II
SpectraBase Compound ID Anc8VEr6WWP
InChI InChI=1S/C41H47F2N2O6P/c1-28(2)45(29(3)4)52(49-25-11-24-44)51-38-26-37(35-14-10-15-36(42)40(35)43)50-39(38)27-48-41(30-12-8-7-9-13-30,31-16-20-33(46-5)21-17-31)32-18-22-34(47-6)23-19-32/h7-10,12-23,28-29,37-39H,11,25-27H2,1-6H3/t37-,38+,39-,52?/m1/s1
InChIKey QWTPWRUVXCGEON-VGKDVMRMSA-N
Mol Weight 732.8 g/mol
Molecular Formula C41H47F2N2O6P
Exact Mass 732.313981 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CreQZHy1Vj2
Name ISOMER-I
Compound Number 4D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C41H47F2N2O6P
InChI InChI=1S/C41H47F2N2O6P/c1-28(2)45(29(3)4)52(49-25-11-24-44)51-38-26-37(35-14-10-15-36(42)40(35)43)50-39(38)27-48-41(30-12-8-7-9-13-30,31-16-20-33(46-5)21-17-31)32-18-22-34(47-6)23-19-32/h7-10,12-23,28-29,37-39H,11,25-27H2,1-6H3/t37-,38+,39-,52?/m1/s1
InChIKey QWTPWRUVXCGEON-VGKDVMRMSA-N
Literature Reference Author A.A.HENRY,A.G.OLSEN,S.MATSUDA,C.YU,B.H.GEIERSTANGER,F.E.ROME SBERG
Literature Reference Citation J.AM.CHEM.SOC.,126,6923(2004)
Literature Reference DOI 10.1021/ja049961u
Solvent CDCl3
Source File Reference UWVN31751