| SpectraBase Spectrum ID |
GrbSg3b3700 |
| Name |
Diisopropyl (E)-2-[2-(adenin-9-yl)ethylidene]-1-cyclopropylphosphonate |
| Alternate Name(s) |
diisopropyl (2E)-2-[2-(6-amino-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 |
C16H24N5O3P |
| InChI |
InChI=1S/C16H24N5O3P/c1-10(2)23-25(22,24-11(3)4)13-7-12(13)5-6-21-9-20-14-15(17)18-8-19-16(14)21/h5,8-11,13H,6-7H2,1-4H3,(H2,17,18,19)/b12-5+ |
| InChIKey |
VXUBFFXHLXVNRW-LFYBBSHMSA-N |
| Molecular Weight |
365.374 g/mol |
| SMILES |
Nc1c2c([n](C\C=C\3C(P(OC(C)C)(OC(C)C)=O)C3)cn2)ncn1 |
| SPLASH |
splash10-0udi-0090000000-310e552c701497bba4ee |
| Source of Spectrum |
F-62-2613-26 |
| Wiley ID |
1632625 |
![Diisopropyl (E)-2-[2-(adenin-9-yl)ethylidene]-1-cyclopropylphosphonate](/api/spectrum/GrbSg3b3700/structure.png?h=300&w=458 "Diisopropyl (E)-2-[2-(adenin-9-yl)ethylidene]-1-cyclopropylphosphonate")
