| SpectraBase Compound ID | 57lQxBOf58g |
|---|---|
| InChI | InChI=1S/C10H6BrN3O3/c11-7-5-12-10(13-6-7)17-9-3-1-8(2-4-9)14(15)16/h1-6H |
| InChIKey | JNHTWWLXXMPNNQ-UHFFFAOYSA-N |
| Mol Weight | 296.08 g/mol |
| Molecular Formula | C10H6BrN3O3 |
| Exact Mass | 294.959254 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9TF7nftNwdI |
|---|---|
| Name | 5-Bromo-2-(4-nitrophenoxy)pyrimidine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 294.959254062 u |
| Formula | C10H6BrN3O3 |
| InChI | InChI=1S/C10H6BrN3O3/c11-7-5-12-10(13-6-7)17-9-3-1-8(2-4-9)14(15)16/h1-6H |
| InChIKey | JNHTWWLXXMPNNQ-UHFFFAOYSA-N |
| Molecular Weight | 296.080 g/mol |
| SMILES | C1(Br)=CN=C(N=C1)OC1=CC=C(C=C1)N(=O)=O |