| SpectraBase Compound ID | 9ftlu71W2Dr |
|---|---|
| InChI | InChI=1S/C17H19N5O/c1-2-6-13(7-3-1)10-18-16-15-17(20-11-19-16)22(12-21-15)14-8-4-5-9-23-14/h1-3,6-7,11-12,14H,4-5,8-10H2,(H,18,19,20) |
| InChIKey | POFWRMVFWIJXHP-UHFFFAOYSA-N |
| Mol Weight | 309.37 g/mol |
| Molecular Formula | C17H19N5O |
| Exact Mass | 309.15896 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DExiu5Nqrzg |
|---|---|
| Name | N-Benzyl-9-(2-tetrahydropyranyl)adenine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 309.158960251 u |
| Formula | C17H19N5O |
| InChI | InChI=1S/C17H19N5O/c1-2-6-13(7-3-1)10-18-16-15-17(20-11-19-16)22(12-21-15)14-8-4-5-9-23-14/h1-3,6-7,11-12,14H,4-5,8-10H2,(H,18,19,20) |
| InChIKey | POFWRMVFWIJXHP-UHFFFAOYSA-N |
| Molecular Weight | 309.373 g/mol |
| SMILES | C1=2N(C=NC1=C(N=CN2)NCC1=CC=CC=C1)C1OCCCC1 |