![3'-O-[(2-CYANOETHYL)-(DIISOPROPYLAMINO)]-PHOSPHINO-5'-O-DIMETHOXYTRITYL-2'-DEOXY-2'-S-[N-(TRIFLUOROACETYL)-2-AMINOBUTYL]-URIDINE](/api/spectrum/KSZzAheq2Wv/structure.png?h=300&w=458 "3'-O-[(2-CYANOETHYL)-(DIISOPROPYLAMINO)]-PHOSPHINO-5'-O-DIMETHOXYTRITYL-2'-DEOXY-2'-S-[N-(TRIFLUOROACETYL)-2-AMINOBUTYL]-URIDINE")
| SpectraBase Compound ID | pT3hTiN7kC |
|---|---|
| InChI | InChI=1S/C45H55F3N5O9PS/c1-30(2)53(31(3)4)63(60-27-12-24-49)62-39-37(61-41(52-26-23-38(54)51-43(52)56)40(39)64-28-11-10-25-50-42(55)45(46,47)48)29-59-44(32-13-8-7-9-14-32,33-15-19-35(57-5)20-16-33)34-17-21-36(58-6)22-18-34/h7-9,13-23,26,30-31,37,39-41H,10-12,25,27-29H2,1-6H3,(H,50,55)(H,51,54,56)/t37-,39-,40-,41-,63?/m0/s1 |
| InChIKey | BRDAGJCINNYPFG-VZWGZYGNSA-N |
| Mol Weight | 930.0 g/mol |
| Molecular Formula | C45H55F3N5O9PS |
| Exact Mass | 929.341021 g/mol |
31P Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KSZzAheq2Wv |
|---|---|
| Name | 3'-O-[(2-CYANOETHYL)-(DIISOPROPYLAMINO)]-PHOSPHINO-5'-O-DIMETHOXYTRITYL-2'-DEOXY-2'-S-[N-(TRIFLUOROACETYL)-2-AMINOBUTYL]-URIDINE |
| Compound Number | 4F |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C45H55F3N5O9PS |
| InChI | InChI=1S/C45H55F3N5O9PS/c1-30(2)53(31(3)4)63(60-27-12-24-49)62-39-37(61-41(52-26-23-38(54)51-43(52)56)40(39)64-28-11-10-25-50-42(55)45(46,47)48)29-59-44(32-13-8-7-9-14-32,33-15-19-35(57-5)20-16-33)34-17-21-36(58-6)22-18-34/h7-9,13-23,26,30-31,37,39-41H,10-12,25,27-29H2,1-6H3,(H,50,55)(H,51,54,56)/t37-,39-,40-,41-,63?/m0/s1 |
| InChIKey | BRDAGJCINNYPFG-VZWGZYGNSA-N |
| Literature Reference Author | L.ZHU,P.S.LUKEMAN,J.W.CANARY,N.C.SEEMAN |
| Literature Reference Citation | J.AM.CHEM.SOC.,125,10178(2003) |
| Literature Reference DOI | 10.1021/ja035186r |
| Solvent | CDCl3 |
| Source File Reference | UWSI35125 |