| SpectraBase Spectrum ID |
8lvJcocjdDy |
| Name |
Diisopropyl (9E)-2-[2-(2-amino-6-chloropurin-9-yl)ethylidene]-1-cyclopropylphosphonate |
| Alternate Name(s) |
diisopropyl (2E)-2-[2-(2-amino-6-chloro-9H-purin-9-yl)ethylidene]cyclopropylphosphonate |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H23ClN5O3P |
| InChI |
InChI=1S/C16H23ClN5O3P/c1-9(2)24-26(23,25-10(3)4)12-7-11(12)5-6-22-8-19-13-14(17)20-16(18)21-15(13)22/h5,8-10,12H,6-7H2,1-4H3,(H2,18,20,21)/b11-5+ |
| InChIKey |
LGXUSHFNEJRTRM-VZUCSPMQSA-N |
| Molecular Weight |
399.819 g/mol |
| SMILES |
Nc1nc(c2c([n](C\C=C\3C(P(OC(C)C)(OC(C)C)=O)C3)cn2)n1)Cl |
| SPLASH |
splash10-001i-0093200000-86b3f768216f30c3570b |
| Source of Spectrum |
F-62-2613-26 |
| Wiley ID |
1632623 |
![Diisopropyl (9E)-2-[2-(2-amino-6-chloropurin-9-yl)ethylidene]-1-cyclopropylphosphonate](/api/spectrum/8lvJcocjdDy/structure.png?h=300&w=458 "Diisopropyl (9E)-2-[2-(2-amino-6-chloropurin-9-yl)ethylidene]-1-cyclopropylphosphonate")
