| SpectraBase Compound ID | f88cQxCjTj |
|---|---|
| InChI | InChI=1S/C8H11NO4/c10-7-3-1-2-6(8(7)11)4-5-9(12)13/h6H,1-5H2 |
| InChIKey | YHSWHOLWHZUZFE-UHFFFAOYSA-N |
| Mol Weight | 185.18 g/mol |
| Molecular Formula | C8H11NO4 |
| Exact Mass | 185.068808 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 65VMUgRkNXD |
|---|---|
| Name | 3-(2-nitroethyl)cyclohexane-1,2-dione |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C8H11NO4 |
| InChI | InChI=1S/C8H11NO4/c10-7-3-1-2-6(8(7)11)4-5-9(12)13/h6H,1-5H2 |
| InChIKey | YHSWHOLWHZUZFE-UHFFFAOYSA-N |
| Molecular Weight | 185.179 g/mol |
| SMILES | C(N(=O)=O)CC1C(C(=O)CCC1)=O |
| SPLASH | splash10-000i-9800000000-12edeb1cfe5fd8bc7d46 |
| Source of Spectrum | Y-34-36-20 |
| Synonyms | 3-(2-nitroethyl)cyclohexane-1,2-quinone |
| Wiley ID | 1181765 |