| SpectraBase Compound ID | 2QynQcjHmCE |
|---|---|
| InChI | InChI=1S/C12H15FN6O4/c1-4(20)15-2-5-7(21)8(22)11(23-5)19-3-16-6-9(14)17-12(13)18-10(6)19/h3,5,7-8,11,21-22H,2H2,1H3,(H,15,20)(H2,14,17,18)/t5-,7-,8-,11-/m1/s1 |
| InChIKey | GARDOWZVKKLKFJ-IOSLPCCCSA-N |
| Mol Weight | 326.29 g/mol |
| Molecular Formula | C12H15FN6O4 |
| Exact Mass | 326.113881 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | FtBBYteGcd9 |
|---|---|
| Name | 5'-N-Acetyl-5'-amino-5'-deoxy-2-fluoroadenosine |
| Appearance | White solid |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C12H15FN6O4 |
| InChI | InChI=1S/C12H15FN6O4/c1-4(20)15-2-5-7(21)8(22)11(23-5)19-3-16-6-9(14)17-12(13)18-10(6)19/h3,5,7-8,11,21-22H,2H2,1H3,(H,15,20)(H2,14,17,18)/t5-,7-,8-,11-/m1/s1 |
| InChIKey | GARDOWZVKKLKFJ-IOSLPCCCSA-N |
| Ionization Type | EI |
| Molecular Weight | 326.288 g/mol |
| Reported Formula | C12H15FN6O4 |
| SMILES | O[C@]1([C@]([C@]([n]2cnc3c(nc(nc23)F)N)(O[C@@]1(CNC(=O)C)[H])[H])(O)[H])[H] |
| SPLASH | splash10-0uk9-0900000000-4272995b132f0aeda357 |
| Source of Spectrum | WO2016168911A1 |
| Wiley ID | 1853296 |