![3'-O-[2-(N-METHYLPYRROLIDINIUM)-ETHYL]-5'-O-TRITYLTHYMIDINE-IODIDE](/api/spectrum/5lBmXTp6wjf/structure.png?h=300&w=458 "3'-O-[2-(N-METHYLPYRROLIDINIUM)-ETHYL]-5'-O-TRITYLTHYMIDINE-IODIDE")
| SpectraBase Compound ID | JVbyM7bTG5H |
|---|---|
| InChI | InChI=1S/C36H41N3O5.HI/c1-27-25-38(35(41)37-34(27)40)33-24-31(42-23-22-39(2)20-12-13-21-39)32(44-33)26-43-36(28-14-6-3-7-15-28,29-16-8-4-9-17-29)30-18-10-5-11-19-30;/h3-11,14-19,25,31-33H,12-13,20-24,26H2,1-2H3;1H/t31-,32+,33+;/m0./s1 |
| InChIKey | VOQSXRZNYDLNTQ-CPYDKYTHSA-N |
| Mol Weight | 723.7 g/mol |
| Molecular Formula | C36H42IN3O5 |
| Exact Mass | 723.216916 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5lBmXTp6wjf |
|---|---|
| Name | 3'-O-[2-(N-METHYLPYRROLIDINIUM)-ETHYL]-5'-O-TRITYLTHYMIDINE-IODIDE |
| Compound Number | 3D |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C36H42IN3O5 |
| InChI | InChI=1S/C36H41N3O5.HI/c1-27-25-38(35(41)37-34(27)40)33-24-31(42-23-22-39(2)20-12-13-21-39)32(44-33)26-43-36(28-14-6-3-7-15-28,29-16-8-4-9-17-29)30-18-10-5-11-19-30;/h3-11,14-19,25,31-33H,12-13,20-24,26H2,1-2H3;1H/t31-,32+,33+;/m0./s1 |
| InChIKey | VOQSXRZNYDLNTQ-CPYDKYTHSA-N |
| Literature Reference Author | S.EL-KOUSY,E.B.PEDERSEN,C.NIELSEN |
| Literature Reference Citation | MH.CHEM.,125,713(1994) |
| Literature Reference DOI | 10.1007/BF01277631 |
| Molecular Weight | 723.651 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWSK1008 |