| SpectraBase Compound ID | 4p0vXY5woHq |
|---|---|
| InChI | InChI=1S/C21H35F3N3O16P3/c1-14-11-27(20(30)26-18(14)28)17-10-15(16(41-17)12-40-45(34,35)43-46(36,37)42-44(31,32)33)39-13-38-9-7-5-3-2-4-6-8-25-19(29)21(22,23)24/h11,15-17H,2-10,12-13H2,1H3,(H,25,29)(H,34,35)(H,36,37)(H,26,28,30)(H2,31,32,33)/t15-,16+,17+/m0/s1 |
| InChIKey | VQQSVPPFDLIALT-GVDBMIGSSA-N |
| Mol Weight | 735.4 g/mol |
| Molecular Formula | C21H35F3N3O16P3 |
| Exact Mass | 735.118228 g/mol |
31P Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | H8x810vZIAn |
|---|---|
| Name | 3'-O-(N-TRIFLUOROACETYL-OMEGA-AMINOOCTOYLMETHYL)-THYMIDINE_5'-TRIPHOSPHATE |
| Compound Number | 9B |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C21H31F3N3O16P3 |
| InChI | InChI=1S/C21H35F3N3O16P3/c1-14-11-27(20(30)26-18(14)28)17-10-15(16(41-17)12-40-45(34,35)43-46(36,37)42-44(31,32)33)39-13-38-9-7-5-3-2-4-6-8-25-19(29)21(22,23)24/h11,15-17H,2-10,12-13H2,1H3,(H,25,29)(H,34,35)(H,36,37)(H,26,28,30)(H2,31,32,33)/t15-,16+,17+/m0/s1 |
| InChIKey | VQQSVPPFDLIALT-GVDBMIGSSA-N |
| Literature Reference Author | J.HOVINEN,E.AZHAYEVA,A.AZHAYEV,A.GUZAEV,H.LOENNBERG |
| Literature Reference Citation | J.CHEM.SOC.PERKIN-1,211(1994) |
| Literature Reference DOI | 10.1039/p19940000211 |
| Solvent | D2O |
| Source File Reference | UWMZ11202 |