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BAYJGGZTPVYYDX-QOUFOPGESA-N
SpectraBase Compound ID KkhW1YZJj1Y
InChI InChI=1S/C20H27N4O11PS/c1-9-5-23(19(29)21-17(9)27)15-3-11(26)14(34-15)8-32-36(31,37)35-12-4-16(33-13(12)7-25)24-6-10(2)18(28)22-20(24)30/h5-6,11-16,25-26H,3-4,7-8H2,1-2H3,(H,31,37)(H,21,27,29)(H,22,28,30)/t11-,12+,13-,14+,15+,16-,36?/m1/s1
InChIKey BAYJGGZTPVYYDX-QOUFOPGESA-N
Mol Weight 562.49 g/mol
Molecular Formula C20H27N4O11PS
Exact Mass 562.113466 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8pOzbe3uXbm
Name BAYJGGZTPVYYDX-QOUFOPGESA-N
Compound Number 10
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H26N4O11PS
InChI InChI=1S/C20H27N4O11PS/c1-9-5-23(19(29)21-17(9)27)15-3-11(26)14(34-15)8-32-36(31,37)35-12-4-16(33-13(12)7-25)24-6-10(2)18(28)22-20(24)30/h5-6,11-16,25-26H,3-4,7-8H2,1-2H3,(H,31,37)(H,21,27,29)(H,22,28,30)/t11-,12+,13-,14+,15+,16-,36?/m1/s1
InChIKey BAYJGGZTPVYYDX-QOUFOPGESA-N
Literature Reference Author Y.JIN,G.JUST
Literature Reference Citation J.ORG.CHEM.,63,3647(1998)
Literature Reference DOI 10.1021/jo972318o
Solvent CD3OD
Source File Reference UWLU37281