| SpectraBase Compound ID | 1K5FBbyim1x |
|---|---|
| InChI | InChI=1S/C14H16N2O3/c1-14(2)8-11(7-13(17)9-14)15-10-3-5-12(6-4-10)16(18)19/h3-7,15H,8-9H2,1-2H3 |
| InChIKey | YAUMXBXKBGPOJL-UHFFFAOYSA-N |
| Mol Weight | 260.29 g/mol |
| Molecular Formula | C14H16N2O3 |
| Exact Mass | 260.116092 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | K3YeHKYzJ0T |
|---|---|
| Name | 5,5-Dimethyl-3-(p-nitroanilino)-2-cyclohexen-1-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 260.116092380 u |
| Formula | C14H16N2O3 |
| InChI | InChI=1S/C14H16N2O3/c1-14(2)8-11(7-13(17)9-14)15-10-3-5-12(6-4-10)16(18)19/h3-7,15H,8-9H2,1-2H3 |
| InChIKey | YAUMXBXKBGPOJL-UHFFFAOYSA-N |
| Molecular Weight | 260.293 g/mol |
| SMILES | N(C1=CC(=O)CC(C)(C)C1)C1=CC=C(C=C1)N(=O)=O |