![1-[4-Aminobenzyl]hypoxanthine](/api/spectrum/82u8dpSVapC/structure.png?h=300&w=458 "1-[4-Aminobenzyl]hypoxanthine")
| SpectraBase Compound ID | HsIIEBZ7Vjr |
|---|---|
| InChI | InChI=1S/C12H11N5O/c13-9-3-1-8(2-4-9)5-17-7-16-11-10(12(17)18)14-6-15-11/h1-4,6-7H,5,13H2,(H,14,15) |
| InChIKey | VWKDHMDJPWGWBV-UHFFFAOYSA-N |
| Mol Weight | 241.25 g/mol |
| Molecular Formula | C12H11N5O |
| Exact Mass | 241.09636 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 82u8dpSVapC |
|---|---|
| Name | 1-[4-Aminobenzyl]hypoxanthine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 241.096359993 u |
| Formula | C12H11N5O |
| InChI | InChI=1S/C12H11N5O/c13-9-3-1-8(2-4-9)5-17-7-16-11-10(12(17)18)14-6-15-11/h1-4,6-7H,5,13H2,(H,14,15) |
| InChIKey | VWKDHMDJPWGWBV-UHFFFAOYSA-N |
| Molecular Weight | 241.254 g/mol |
| SMILES | C1=CC(=CC=C1CN1C=NC2=C(C1=O)N=CN2)N |