![4-[o-Fluorobenzylamino]-1-.beta.-D-ribofuranosylpyrazolo[3,4-D]pyrimidine](/api/spectrum/LtTO99OpR1j/structure.png?h=300&w=458 "4-[o-Fluorobenzylamino]-1-.beta.-D-ribofuranosylpyrazolo[3,4-D]pyrimidine")
| SpectraBase Compound ID | 8JItoGA4Ndh |
|---|---|
| InChI | InChI=1S/C17H18FN5O4/c18-11-4-2-1-3-9(11)5-19-15-10-6-22-23(16(10)21-8-20-15)17-14(26)13(25)12(7-24)27-17/h1-4,6,8,12-14,17,24-26H,5,7H2,(H,19,20,21) |
| InChIKey | KDNUEZWOZGLAIQ-UHFFFAOYSA-N |
| Mol Weight | 375.36 g/mol |
| Molecular Formula | C17H18FN5O4 |
| Exact Mass | 375.134282 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LtTO99OpR1j |
|---|---|
| Name | 4-[o-Fluorobenzylamino]-1-.beta.-D-ribofuranosylpyrazolo[3,4-D]pyrimidine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 375.134282239 u |
| Formula | C17H18FN5O4 |
| InChI | InChI=1S/C17H18FN5O4/c18-11-4-2-1-3-9(11)5-19-15-10-6-22-23(16(10)21-8-20-15)17-14(26)13(25)12(7-24)27-17/h1-4,6,8,12-14,17,24-26H,5,7H2,(H,19,20,21) |
| InChIKey | KDNUEZWOZGLAIQ-UHFFFAOYSA-N |
| Molecular Weight | 375.360 g/mol |
| SMILES | C1(=NC=NC2=C1C=NN2C1OC(C(O)C1O)CO)NCC1=C(C=CC=C1)F |