| SpectraBase Compound ID | JSy1lLnjErY |
|---|---|
| InChI | InChI=1S/C22H24N2O3/c25-21(15-17-7-3-1-4-8-17)27-20-13-11-18(12-14-20)16-23-24-22(26)19-9-5-2-6-10-19/h1,3-4,7-8,11-14,16,19H,2,5-6,9-10,15H2,(H,24,26)/b23-16+ |
| InChIKey | MKMGADRKMLSAIW-XQNSMLJCSA-N |
| Mol Weight | 364.45 g/mol |
| Molecular Formula | C22H24N2O3 |
| Exact Mass | 364.178693 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7DIieWfvbZI |
|---|---|
| Name | Phenylacetic acid, 4-(cyclohexanecarbonylhydrazonomethyl)phenyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 364.178692638 u |
| Formula | C22H24N2O3 |
| InChI | InChI=1S/C22H24N2O3/c25-21(15-17-7-3-1-4-8-17)27-20-13-11-18(12-14-20)16-23-24-22(26)19-9-5-2-6-10-19/h1,3-4,7-8,11-14,16,19H,2,5-6,9-10,15H2,(H,24,26)/b23-16+ |
| InChIKey | MKMGADRKMLSAIW-XQNSMLJCSA-N |
| Molecular Weight | 364.445 g/mol |
| SMILES | C(N\N=C\C=1C=CC(OC(=O)CC=2C=CC=CC2)=CC1)(=O)C1CCCCC1 |