![5'-o-(4,4'-Dimethoxytrityl)-N6-methyl-2'-o-[[(triisopropylsilyl)-oxy]-methyl]-adenosine-3'-(2-cyanoethyl-diisopropyl-phosphoramidite)](/api/spectrum/BNIENP47lYF/structure.png?h=300&w=458 "5'-o-(4,4'-Dimethoxytrityl)-N6-methyl-2'-o-[[(triisopropylsilyl)-oxy]-methyl]-adenosine-3'-(2-cyanoethyl-diisopropyl-phosphoramidite)")
| SpectraBase Compound ID | 8oEAeKtg758 |
|---|---|
| InChI | InChI=1S/C51H72N7O8PSi/c1-34(2)58(35(3)4)67(63-29-17-28-52)66-46-44(30-62-51(39-18-15-14-16-19-39,40-20-24-42(59-12)25-21-40)41-22-26-43(60-13)27-23-41)65-50(57-32-56-45-48(53-11)54-31-55-49(45)57)47(46)61-33-64-68(36(5)6,37(7)8)38(9)10/h14-16,18-27,31-32,34-38,44,46-47,50H,17,29-30,33H2,1-13H3,(H,53,54,55)/t44-,46-,47-,50-,67?/m0/s1 |
| InChIKey | ZDYIVHOLEUPGCD-GHRKUBOHSA-N |
| Mol Weight | 970.2 g/mol |
| Molecular Formula | C51H72N7O8PSi |
| Exact Mass | 969.494926 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BNIENP47lYF |
|---|---|
| Name | 5'-o-(4,4'-Dimethoxytrityl)-N6-methyl-2'-o-[[(triisopropylsilyl)-oxy]-methyl]-adenosine-3'-(2-cyanoethyl-diisopropyl-phosphoramidite) |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 969.494925831 u |
| Formula | C51H72N7O8PSi |
| InChI | InChI=1S/C51H72N7O8PSi/c1-34(2)58(35(3)4)67(63-29-17-28-52)66-46-44(30-62-51(39-18-15-14-16-19-39,40-20-24-42(59-12)25-21-40)41-22-26-43(60-13)27-23-41)65-50(57-32-56-45-48(53-11)54-31-55-49(45)57)47(46)61-33-64-68(36(5)6,37(7)8)38(9)10/h14-16,18-27,31-32,34-38,44,46-47,50H,17,29-30,33H2,1-13H3,(H,53,54,55)/t44-,46-,47-,50-,67?/m0/s1 |
| InChIKey | ZDYIVHOLEUPGCD-GHRKUBOHSA-N |
| Molecular Weight | 970.237 g/mol |
| SMILES | C1=NC=2N(C=NC2C(=N1)NC)[C@]1(O[C@]([C@@]([C@@]1(OCO[Si](C(C)C)(C(C)C)C(C)C)[H])(OP(N(C(C)C)C(C)C)OCCC#N)[H])(COC(C1=CC=CC=C1)(C1=CC=C(OC)C=C1)C1=CC=C(OC)C=C1)[H])[H] |