| SpectraBase Compound ID | TEQpKC78Xn |
|---|---|
| InChI | InChI=1S/C14H17NO2/c1-14(2)8-11(7-13(17)9-14)15-10-3-5-12(16)6-4-10/h3-7,15-16H,8-9H2,1-2H3 |
| InChIKey | YOXNZHPNAXSUNO-UHFFFAOYSA-N |
| Mol Weight | 231.29 g/mol |
| Molecular Formula | C14H17NO2 |
| Exact Mass | 231.125929 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | EHm6HyAREyt |
|---|---|
| Name | 3-(4-Hydroxyanilino)-5,5-dimethyl-2-cyclohexen-1-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 231.125928789 u |
| Formula | C14H17NO2 |
| InChI | InChI=1S/C14H17NO2/c1-14(2)8-11(7-13(17)9-14)15-10-3-5-12(16)6-4-10/h3-7,15-16H,8-9H2,1-2H3 |
| InChIKey | YOXNZHPNAXSUNO-UHFFFAOYSA-N |
| Molecular Weight | 231.295 g/mol |
| SMILES | C1(C=C(CC(C1)(C)C)NC1=CC=C(C=C1)O)=O |