| SpectraBase Compound ID | JOBDELGQoNV |
|---|---|
| InChI | InChI=1S/C7H12O/c1-6-3-2-4-7(8)5-6/h6H,2-5H2,1H3 |
| InChIKey | UJBOOUHRTQVGRU-UHFFFAOYSA-N |
| Mol Weight | 112.17 g/mol |
| Molecular Formula | C7H12O |
| Exact Mass | 112.088815 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AxXYP1HqF6u |
|---|---|
| Name | 3-METHYLCYCLOHEXANONE |
| Source of Sample | Aldrich Chemical Company, Inc., Milwaukee, Wisconsin |
| Boiling Point | 168-169C |
| Copyright | Copyright © 1980, 1981-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C7H12O |
| InChI | InChI=1S/C7H12O/c1-6-3-2-4-7(8)5-6/h6H,2-5H2,1H3 |
| InChIKey | UJBOOUHRTQVGRU-UHFFFAOYSA-N |
| Melting Point | 74C |
| Molecular Weight | 112.17 |
| Solvent | Chloroform-d; Reference=TMS Spectrometer= Varian CFT-20 |
| Synonyms | CYCLOHEXANONE, 3-METHYL-, |