![9-[2-(benzylamino)ethyl]-9H-purin-6-amine](/api/spectrum/IuGQhV7KCe6/structure.png?h=300&w=458 "9-[2-(benzylamino)ethyl]-9H-purin-6-amine")
| SpectraBase Compound ID | 3osikMZHt0G |
|---|---|
| InChI | InChI=1S/C14H16N6/c15-13-12-14(18-9-17-13)20(10-19-12)7-6-16-8-11-4-2-1-3-5-11/h1-5,9-10,16H,6-8H2,(H2,15,17,18) |
| InChIKey | SCSURRDSNJCDQA-UHFFFAOYSA-N |
| Mol Weight | 268.32 g/mol |
| Molecular Formula | C14H16N6 |
| Exact Mass | 268.143645 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IuGQhV7KCe6 |
|---|---|
| Name | 9-[2-(Benzylamino)ethyl]-9H-purin-6-amine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 268.143644539 u |
| Formula | C14H16N6 |
| InChI | InChI=1S/C14H16N6/c15-13-12-14(18-9-17-13)20(10-19-12)7-6-16-8-11-4-2-1-3-5-11/h1-5,9-10,16H,6-8H2,(H2,15,17,18) |
| InChIKey | SCSURRDSNJCDQA-UHFFFAOYSA-N |
| Molecular Weight | 268.324 g/mol |
| SMILES | NC=1C2=C(N(CCNCC=3C=CC=CC3)C=N2)N=CN1 |