| SpectraBase Compound ID | 1JXIOU2Fsvf |
|---|---|
| InChI | InChI=1S/C11H9N3O3/c15-13-7-3-6-12-11(13)8-9-4-1-2-5-10(9)14(16)17/h1-7H,8H2 |
| InChIKey | MSRBDEZUIFNQHK-UHFFFAOYSA-N |
| Mol Weight | 231.21 g/mol |
| Molecular Formula | C11H9N3O3 |
| Exact Mass | 231.064391 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 1EB4DjQap4N |
|---|---|
| Name | 2-(2-Nitrobenzyl)pyrimidine 1-oxide |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C11H9N3O3 |
| InChI | InChI=1S/C11H9N3O3/c15-13-7-3-6-12-11(13)8-9-4-1-2-5-10(9)14(16)17/h1-7H,8H2 |
| InChIKey | MSRBDEZUIFNQHK-UHFFFAOYSA-N |
| Molecular Weight | 231.211 g/mol |
| SMILES | c1(N(=O)=O)c(Cc2[n+]([O-])cccn2)cccc1 |
| SPLASH | splash10-02t9-0790000000-896938ecb957e7098842 |
| Source of Spectrum | F-54-4394-2 |
| Wiley ID | 806564 |