| SpectraBase Compound ID | 8D4N4Fs2pT1 |
|---|---|
| InChI | InChI=1S/C6H7N3O3/c1-4(10)6-7-3-5(8(6)2)9(11)12/h3H,1-2H3 |
| InChIKey | ANSCCMZPJWEICB-UHFFFAOYSA-N |
| Mol Weight | 169.14 g/mol |
| Molecular Formula | C6H7N3O3 |
| Exact Mass | 169.048741 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 1QGYaXgHOi |
|---|---|
| Name | 1-(1-Methyl-5-nitro-2-imidazolyl)ethanone |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C6H7N3O3 |
| InChI | InChI=1S/C6H7N3O3/c1-4(10)6-7-3-5(8(6)2)9(11)12/h3H,1-2H3 |
| InChIKey | ANSCCMZPJWEICB-UHFFFAOYSA-N |
| Molecular Weight | 169.140 g/mol |
| SMILES | c1([n](c(C(=O)C)nc1)C)N(=O)=O |
| SPLASH | splash10-0fsr-8900000000-6e1179ae36806bba8b2a |
| Source of Spectrum | Y-29-1022-1 |
| Synonyms | 1-(1-Methyl-5-nitro-imidazol-2-yl)ethanone |
| Wiley ID | 1165588 |