| SpectraBase Compound ID | 9uxbdQwED2b |
|---|---|
| InChI | InChI=1S/C6H6N2O3/c1-4(9)5-2-7-3-6(5)8(10)11/h2-3,7H,1H3 |
| InChIKey | CKDHKICODUBLFB-UHFFFAOYSA-N |
| Mol Weight | 154.12 g/mol |
| Molecular Formula | C6H6N2O3 |
| Exact Mass | 154.037842 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | CzPJKqRMain |
|---|---|
| Name | 3-Acetyl-4-nitropyrrole |
| Alternate Name(s) | 1-(4-nitro-1H-pyrrol-3-yl)ethanone |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C6H6N2O3 |
| InChI | InChI=1S/C6H6N2O3/c1-4(9)5-2-7-3-6(5)8(10)11/h2-3,7H,1H3 |
| InChIKey | CKDHKICODUBLFB-UHFFFAOYSA-N |
| Molecular Weight | 154.125 g/mol |
| SMILES | [nH]1cc(c(c1)N(=O)=O)C(=O)C |
| SPLASH | splash10-000i-3900000000-cd977ceed981f287b951 |
| Source of Spectrum | SO-0-1455-11 |
| Wiley ID | 875038 |