| SpectraBase Compound ID | tFMhvYv6Vj |
|---|---|
| InChI | InChI=1S/C18H25NO3/c1-3-5-7-14-9-11-15(12-10-14)17(20)19-13-6-8-16(19)18(21)22-4-2/h9-12,16H,3-8,13H2,1-2H3 |
| InChIKey | PADJIZAEYUVZHX-UHFFFAOYSA-N |
| Mol Weight | 303.4 g/mol |
| Molecular Formula | C18H25NO3 |
| Exact Mass | 303.183444 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AXbryFhFlBK |
|---|---|
| Name | L-Proline, N-(4-butylbenzoyl)-, ethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 303.183443666 u |
| Formula | C18H25NO3 |
| InChI | InChI=1S/C18H25NO3/c1-3-5-7-14-9-11-15(12-10-14)17(20)19-13-6-8-16(19)18(21)22-4-2/h9-12,16H,3-8,13H2,1-2H3 |
| InChIKey | PADJIZAEYUVZHX-UHFFFAOYSA-N |
| Molecular Weight | 303.402 g/mol |
| SMILES | C1=C(C=CC(=C1)CCCC)C(N1CCCC1C(=O)OCC)=O |