| SpectraBase Compound ID | 3ZWYoddPeSA |
|---|---|
| InChI | InChI=1S/C7H11NO3/c9-7-3-1-2-6(4-7)5-8(10)11/h6H,1-5H2 |
| InChIKey | KZRJSGQVSDJUFG-UHFFFAOYSA-N |
| Mol Weight | 157.17 g/mol |
| Molecular Formula | C7H11NO3 |
| Exact Mass | 157.073893 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | JxxT8ANe3WR |
|---|---|
| Name | 3-(nitromethyl)-1-cyclohexanone |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C7H11NO3 |
| InChI | InChI=1S/C7H11NO3/c9-7-3-1-2-6(4-7)5-8(10)11/h6H,1-5H2 |
| InChIKey | KZRJSGQVSDJUFG-UHFFFAOYSA-N |
| Molecular Weight | 157.169 g/mol |
| SMILES | C(N(=O)=O)C1CC(=O)CCC1 |
| SPLASH | splash10-0a4i-9100000000-a032f6df6908eda4310f |
| Source of Spectrum | F-52-8213-3 |
| Synonyms | 3-(Nitromethyl)cyclohexanone |
| Wiley ID | 796934 |