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N-(4)-BENZOYL-5'-O-(4,4'-DIMETHOXYTRITYL)-3'-O-[(N,N-DIISOPROPYLAMINO)-(4-METHYLTHIO-1-BUTYLOXY)]-PHOSPHINYL-2'-DEOXYTHYMIDINE

View entire compound with spectra: 1 NMR

N-(4)-BENZOYL-5'-O-(4,4'-DIMETHOXYTRITYL)-3'-O-[(N,N-DIISOPROPYLAMINO)-(4-METHYLTHIO-1-BUTYLOXY)]-PHOSPHINYL-2'-DEOXYTHYMIDINE
SpectraBase Compound ID HGsI8lCk9DX
InChI InChI=1S/2C48H59N4O8PS/c2*1-34(2)52(35(3)4)61(58-30-14-15-31-62-7)60-42-32-45(51-29-28-44(50-47(51)54)49-46(53)36-16-10-8-11-17-36)59-43(42)33-57-48(37-18-12-9-13-19-37,38-20-24-40(55-5)25-21-38)39-22-26-41(56-6)27-23-39/h2*8-13,16-29,34-35,42-43,45H,14-15,30-33H2,1-7H3,(H,49,50,53,54)/t2*42-,43+,45+,61?/m11/s1
InChIKey NPSALQOHJDPXRS-FFOHUMOUSA-N
Mol Weight 1766.1 g/mol
Molecular Formula C96H118N8O16P2S2
Exact Mass 1764.758246 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4W9ooK1u2Uu
Name N-(4)-BENZOYL-5'-O-(4,4'-DIMETHOXYTRITYL)-3'-O-[(N,N-DIISOPROPYLAMINO)-(4-METHYLTHIO-1-BUTYLOXY)]-PHOSPHINYL-2'-DEOXYTHYMIDINE
Compound Number 10B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C96H118N8O16P2S2
InChI InChI=1S/2C48H59N4O8PS/c2*1-34(2)52(35(3)4)61(58-30-14-15-31-62-7)60-42-32-45(51-29-28-44(50-47(51)54)49-46(53)36-16-10-8-11-17-36)59-43(42)33-57-48(37-18-12-9-13-19-37,38-20-24-40(55-5)25-21-38)39-22-26-41(56-6)27-23-39/h2*8-13,16-29,34-35,42-43,45H,14-15,30-33H2,1-7H3,(H,49,50,53,54)/t2*42-,43+,45+,61?/m11/s1
InChIKey NPSALQOHJDPXRS-FFOHUMOUSA-N
Literature Reference Author J.CIESLAK,A.GRAJKOWSKI,V.LIVENGOOD,S.BEAUCAGE
Literature Reference Citation J.ORG.CHEM.,69,2509(2004)
Literature Reference DOI 10.1021/jo035861f
Solvent CDCl3
Source File Reference UWVN21448