| SpectraBase Compound ID | KaFPXHkpNA3 |
|---|---|
| InChI | InChI=1S/C18H26N2O3/c1-14(2)13-23-18(22)15-6-8-16(9-7-15)19-17(21)12-20-10-4-3-5-11-20/h6-9,14H,3-5,10-13H2,1-2H3,(H,19,21) |
| InChIKey | WQJAXDAWFQSPCV-UHFFFAOYSA-N |
| Mol Weight | 318.42 g/mol |
| Molecular Formula | C18H26N2O3 |
| Exact Mass | 318.194343 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | J9k36ONAjnO |
|---|---|
| Name | p-(2-Piperidinoacetamido)benzoic acid, isobutyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 318.194342702 u |
| Formula | C18H26N2O3 |
| InChI | InChI=1S/C18H26N2O3/c1-14(2)13-23-18(22)15-6-8-16(9-7-15)19-17(21)12-20-10-4-3-5-11-20/h6-9,14H,3-5,10-13H2,1-2H3,(H,19,21) |
| InChIKey | WQJAXDAWFQSPCV-UHFFFAOYSA-N |
| SMILES | N(C1=CC=C(C=C1)C(OCC(C)C)=O)C(CN1CCCCC1)=O |