| SpectraBase Compound ID | 4kJD9lf6iZE |
|---|---|
| InChI | InChI=1S/C11H13N3O4/c15-5-8-9(16)10(17)11(18-8)14-7-4-2-1-3-6(7)12-13-14/h1-4,8-11,15-17H,5H2 |
| InChIKey | FVOKDLHCFYDWMQ-UHFFFAOYSA-N |
| Mol Weight | 251.24 g/mol |
| Molecular Formula | C11H13N3O4 |
| Exact Mass | 251.090606 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1ucADwIo6H2 |
|---|---|
| Name | 1H-1-Pentofuranosyl-1,2,3-benzotriazol |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 251.090605907 u |
| Formula | C11H13N3O4 |
| InChI | InChI=1S/C11H13N3O4/c15-5-8-9(16)10(17)11(18-8)14-7-4-2-1-3-6(7)12-13-14/h1-4,8-11,15-17H,5H2 |
| InChIKey | FVOKDLHCFYDWMQ-UHFFFAOYSA-N |
| Molecular Weight | 251.242 g/mol |
| SMILES | C12=C(C=CC=C2)N=NN1C1C(C(C(CO)O1)O)O |