| SpectraBase Spectrum ID |
AmNuNrkCkfq |
| Name |
3,5-Diacetyl-5-iodo-2'-deoxyuridine |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
437.992395824 u |
| Formula |
C13H15IN2O7 |
| InChI |
InChI=1S/C13H15IN2O7/c1-6(17)21-5-10-9(22-7(2)18)3-11(23-10)16-4-8(14)12(19)15-13(16)20/h4,9-11H,3,5H2,1-2H3,(H,15,19,20) |
| InChIKey |
LVDYIZDWXVFTQG-UHFFFAOYSA-N |
| Molecular Weight |
438.174 g/mol |
| SMILES |
C1(I)=CN(C2CC(OC(C)=O)C(O2)COC(C)=O)C(NC1=O)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.931673 |
