| SpectraBase Compound ID | BJHDgpioTfO |
|---|---|
| InChI | InChI=1S/C12H21NO/c1-9(2)8-13-10-5-11(14)7-12(3,4)6-10/h5,9,13H,6-8H2,1-4H3 |
| InChIKey | TWJANHDHUVWEPJ-UHFFFAOYSA-N |
| Mol Weight | 195.31 g/mol |
| Molecular Formula | C12H21NO |
| Exact Mass | 195.162314 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6i0Xb0uvO3G |
|---|---|
| Name | 5,5-Dimethyl-3-(isobutylamino)-2-cyclohexen-1-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 195.162314299 u |
| Formula | C12H21NO |
| InChI | InChI=1S/C12H21NO/c1-9(2)8-13-10-5-11(14)7-12(3,4)6-10/h5,9,13H,6-8H2,1-4H3 |
| InChIKey | TWJANHDHUVWEPJ-UHFFFAOYSA-N |
| Molecular Weight | 195.306 g/mol |
| SMILES | N(C1=CC(CC(C1)(C)C)=O)CC(C)C |