![5'-O-(4,4'-DIMETHOXYTRITYL)-3'-O-(N,N-DIETHYLAMINO)-[3-(N-TERT.-BUTYLCARBOXAMIDO)-1-PROPYLOXY]-PHOSPHINYL-2'-DEOXYTHYMIDINE](/api/spectrum/KE0qAP0b8YU/structure.png?h=300&w=458 "5'-O-(4,4'-DIMETHOXYTRITYL)-3'-O-(N,N-DIETHYLAMINO)-[3-(N-TERT.-BUTYLCARBOXAMIDO)-1-PROPYLOXY]-PHOSPHINYL-2'-DEOXYTHYMIDINE")
| SpectraBase Compound ID | CIBSNtSZgGA |
|---|---|
| InChI | InChI=1S/2C43H57N4O9P/c2*1-9-46(10-2)57(54-26-14-17-38(48)45-42(4,5)6)56-36-27-39(47-28-30(3)40(49)44-41(47)50)55-37(36)29-53-43(31-15-12-11-13-16-31,32-18-22-34(51-7)23-19-32)33-20-24-35(52-8)25-21-33/h2*11-13,15-16,18-25,28,36-37,39H,9-10,14,17,26-27,29H2,1-8H3,(H,45,48)(H,44,49,50)/t2*36-,37+,39+,57?/m11/s1 |
| InChIKey | ZJNFFNRNCJGJQI-JAZRDDOJSA-N |
| Mol Weight | 1609.8 g/mol |
| Molecular Formula | C86H114N8O18P2 |
| Exact Mass | 1608.772633 g/mol |
31P Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KE0qAP0b8YU |
|---|---|
| Name | 5'-O-(4,4'-DIMETHOXYTRITYL)-3'-O-(N,N-DIETHYLAMINO)-[3-(N-TERT.-BUTYLCARBOXAMIDO)-1-PROPYLOXY]-PHOSPHINYL-2'-DEOXYTHYMIDINE |
| Compound Number | 7 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C86H114N8O18P2 |
| InChI | InChI=1S/2C43H57N4O9P/c2*1-9-46(10-2)57(54-26-14-17-38(48)45-42(4,5)6)56-36-27-39(47-28-30(3)40(49)44-41(47)50)55-37(36)29-53-43(31-15-12-11-13-16-31,32-18-22-34(51-7)23-19-32)33-20-24-35(52-8)25-21-33/h2*11-13,15-16,18-25,28,36-37,39H,9-10,14,17,26-27,29H2,1-8H3,(H,45,48)(H,44,49,50)/t2*36-,37+,39+,57?/m11/s1 |
| InChIKey | ZJNFFNRNCJGJQI-JAZRDDOJSA-N |
| Literature Reference Author | A.WILK,M.K.CHMIELEWSKI,A.GRAJKOWSKI,L.R.PHILLIPS,S.L.BEAUCAG E |
| Literature Reference Citation | J.ORG.CHEM.,67,6430(2002) |
| Literature Reference DOI | 10.1021/jo0258608 |
| Solvent | C6D6 |
| Source File Reference | UWSI22011 |