| SpectraBase Spectrum ID |
Kqww7vG6uCe |
| Name |
Diethyl-2-[4-[(2-amino-6-oxo-1,6-dihydro-9H-purin-9-yl)-methyl]-1H-1,2,3-triazol-1-yl]-1-hydroxyethylphosphonate |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
412.137252801 u |
| Formula |
C14H21N8O5P |
| InChI |
InChI=1S/C14H21N8O5P/c1-3-26-28(25,27-4-2)10(23)7-22-6-9(19-20-22)5-21-8-16-11-12(21)17-14(15)18-13(11)24/h6,8,10,23H,3-5,7H2,1-2H3,(H3,15,17,18,24) |
| InChIKey |
UOYLZDHHBPNPOG-UHFFFAOYSA-N |
| Molecular Weight |
412.347 g/mol |
| SMILES |
C=1(NC(C2=C(N1)N(C=N2)CC1=CN(N=N1)CC(O)P(=O)(OCC)OCC)=O)N |
![Diethyl-2-[4-[(2-amino-6-oxo-1,6-dihydro-9H-purin-9-yl)-methyl]-1H-1,2,3-triazol-1-yl]-1-hydroxyethylphosphonate](/api/spectrum/Kqww7vG6uCe/structure.png?h=300&w=458 "Diethyl-2-[4-[(2-amino-6-oxo-1,6-dihydro-9H-purin-9-yl)-methyl]-1H-1,2,3-triazol-1-yl]-1-hydroxyethylphosphonate")
