![2-[(4-Phenyl-1-piperazinyl)carbonyl]cyclohexanecarboxylic acid](/api/spectrum/EDCj1Y51TAE/structure.png?h=300&w=458 "2-[(4-Phenyl-1-piperazinyl)carbonyl]cyclohexanecarboxylic acid")
| SpectraBase Compound ID | 5eZ1smVfYYR |
|---|---|
| InChI | InChI=1S/C18H24N2O3/c21-17(15-8-4-5-9-16(15)18(22)23)20-12-10-19(11-13-20)14-6-2-1-3-7-14/h1-3,6-7,15-16H,4-5,8-13H2,(H,22,23) |
| InChIKey | IVBNPKKPTFYBLS-UHFFFAOYSA-N |
| Mol Weight | 316.4 g/mol |
| Molecular Formula | C18H24N2O3 |
| Exact Mass | 316.178693 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 | EDCj1Y51TAE |
|---|---|
| Name | 2-[(4-Phenyl-1-piperazinyl)carbonyl]cyclohexanecarboxylic acid |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 316.178692638 u |
| Formula | C18H24N2O3 |
| InChI | InChI=1S/C18H24N2O3/c21-17(15-8-4-5-9-16(15)18(22)23)20-12-10-19(11-13-20)14-6-2-1-3-7-14/h1-3,6-7,15-16H,4-5,8-13H2,(H,22,23) |
| InChIKey | IVBNPKKPTFYBLS-UHFFFAOYSA-N |
| SMILES | OC(C1C(C(N2CCN(C=3C=CC=CC3)CC2)=O)CCCC1)=O |