For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

N-(6)-BENZOYL-5'-O-(4,4'-DIMETHOXYTRITYL)-3'-O-[(N,N-DIISOPROPYLAMINO)-(4-METHYLTHIO-1-BUTYLOXY)]-PHOSPHINYL-2'-DEOXYADENOSINE

View entire compound with spectra: 1 NMR

N-(6)-BENZOYL-5'-O-(4,4'-DIMETHOXYTRITYL)-3'-O-[(N,N-DIISOPROPYLAMINO)-(4-METHYLTHIO-1-BUTYLOXY)]-PHOSPHINYL-2'-DEOXYADENOSINE
SpectraBase Compound ID ABV3BqLoxfn
InChI InChI=1S/2C49H59N6O7PS/c2*1-34(2)55(35(3)4)63(60-28-14-15-29-64-7)62-42-30-44(54-33-52-45-46(50-32-51-47(45)54)53-48(56)36-16-10-8-11-17-36)61-43(42)31-59-49(37-18-12-9-13-19-37,38-20-24-40(57-5)25-21-38)39-22-26-41(58-6)27-23-39/h2*8-13,16-27,32-35,42-44H,14-15,28-31H2,1-7H3,(H,50,51,53,56)/t2*42-,43+,44+,63?/m11/s1
InChIKey JAKZWHDRQKHLHZ-AJSCEEAJSA-N
Mol Weight 1814.2 g/mol
Molecular Formula C98H118N12O14P2S2
Exact Mass 1812.780713 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID P0YXN2DgD1
Name N-(6)-BENZOYL-5'-O-(4,4'-DIMETHOXYTRITYL)-3'-O-[(N,N-DIISOPROPYLAMINO)-(4-METHYLTHIO-1-BUTYLOXY)]-PHOSPHINYL-2'-DEOXYADENOSINE
Compound Number 10C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C98H118N12O14P2S2
InChI InChI=1S/2C49H59N6O7PS/c2*1-34(2)55(35(3)4)63(60-28-14-15-29-64-7)62-42-30-44(54-33-52-45-46(50-32-51-47(45)54)53-48(56)36-16-10-8-11-17-36)61-43(42)31-59-49(37-18-12-9-13-19-37,38-20-24-40(57-5)25-21-38)39-22-26-41(58-6)27-23-39/h2*8-13,16-27,32-35,42-44H,14-15,28-31H2,1-7H3,(H,50,51,53,56)/t2*42-,43+,44+,63?/m11/s1
InChIKey JAKZWHDRQKHLHZ-AJSCEEAJSA-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 UWVN21449