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(S(P))-5'-O-DIMETHOXYTRITYL-N(4)-BENZOYL-2'-DEOXYCYTIDINE-3'-O-(SE-METHYLMETHANEPHOSPHONOSELENOLATE);FAST-(S(P))
SpectraBase Compound ID 6snkXHH1L1a
InChI InChI=1S/C39H40N3O8PSe/c1-46-31-19-15-29(16-20-31)39(28-13-9-6-10-14-28,30-17-21-32(47-2)22-18-30)48-26-34-33(50-51(3,45)52-4)25-36(49-34)42-24-23-35(41-38(42)44)40-37(43)27-11-7-5-8-12-27/h5-24,33-34,36H,25-26H2,1-4H3,(H,40,41,43,44)/t33-,34+,36+,51?/m1/s1
InChIKey JYCVSGIDOUZZAC-JLSPNDPXSA-N
Mol Weight 788.7 g/mol
Molecular Formula C39H40N3O8PSe
Exact Mass 789.171824 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8jlePsMDQ6j
Name (S(P))-5'-O-DIMETHOXYTRITYL-N(4)-BENZOYL-2'-DEOXYCYTIDINE-3'-O-(SE-METHYLMETHANEPHOSPHONOSELENOLATE);FAST-(S(P))
Compound Number 4'
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C39H40N3O8PSe
InChI InChI=1S/C39H40N3O8PSe/c1-46-31-19-15-29(16-20-31)39(28-13-9-6-10-14-28,30-17-21-32(47-2)22-18-30)48-26-34-33(50-51(3,45)52-4)25-36(49-34)42-24-23-35(41-38(42)44)40-37(43)27-11-7-5-8-12-27/h5-24,33-34,36H,25-26H2,1-4H3,(H,40,41,43,44)/t33-,34+,36+,51?/m1/s1
InChIKey JYCVSGIDOUZZAC-JLSPNDPXSA-N
Literature Reference Author L.A.WOZNIAK,M.WIECZOREK,J.PYZOWSKI,W.MAJZNER,W.J.STEC
Literature Reference Citation J.ORG.CHEM.,63,5395(1998)
Literature Reference DOI 10.1021/jo980225g
Solvent DMSO-D6
Source File Reference UWSI28683