| SpectraBase Compound ID | LqsoUo2cnWL |
|---|---|
| InChI | InChI=1S/C11H11NO4/c1-7(13)11(8(2)14)9-3-5-10(6-4-9)12(15)16/h3-6,11H,1-2H3 |
| InChIKey | IBXXQJNVHFSRAV-UHFFFAOYSA-N |
| Mol Weight | 221.21 g/mol |
| Molecular Formula | C11H11NO4 |
| Exact Mass | 221.068808 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | IWeMrt6ddmF |
|---|---|
| Name | 3-(4-Nitrophenyl)pentane-2,4-dione |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C11H11NO4 |
| InChI | InChI=1S/C11H11NO4/c1-7(13)11(8(2)14)9-3-5-10(6-4-9)12(15)16/h3-6,11H,1-2H3 |
| InChIKey | IBXXQJNVHFSRAV-UHFFFAOYSA-N |
| Molecular Weight | 221.212 g/mol |
| SMILES | c1cc(ccc1C(C(C)=O)C(C)=O)N(=O)=O |
| SPLASH | splash10-0ac3-5690000000-76276669f93a5cd07972 |
| Source of Spectrum | F-48-6915-6 |
| Wiley ID | 1221152 |