![N-[1-(2,6-dioxo-4,4-dimethylcyclohaxanylidene)ethyl]ethanolamine](/api/spectrum/GaPionHrb4q/structure.png?h=300&w=458 "N-[1-(2,6-dioxo-4,4-dimethylcyclohaxanylidene)ethyl]ethanolamine")
| SpectraBase Compound ID | 6HjIt2DIMZd |
|---|---|
| InChI | InChI=1S/C12H19NO3/c1-8(13-4-5-14)11-9(15)6-12(2,3)7-10(11)16/h13-14H,4-7H2,1-3H3 |
| InChIKey | ALPHMMHXDNYUIL-UHFFFAOYSA-N |
| Mol Weight | 225.29 g/mol |
| Molecular Formula | C12H19NO3 |
| Exact Mass | 225.136493 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GaPionHrb4q |
|---|---|
| Name | N-[1-(2,6-Dioxo-4,4-dimethylcyclohaxanylidene)ethyl]ethanolamine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 225.136493473 u |
| Formula | C12H19NO3 |
| InChI | InChI=1S/C12H19NO3/c1-8(13-4-5-14)11-9(15)6-12(2,3)7-10(11)16/h13-14H,4-7H2,1-3H3 |
| InChIKey | ALPHMMHXDNYUIL-UHFFFAOYSA-N |
| Molecular Weight | 225.288 g/mol |
| SMILES | N(C(=C1C(CC(CC1=O)(C)C)=O)C)CCO |