![N-[3-[2-[2-(2-hydroxy-6-methyl-phenyl)-2-keto-ethyl]pyrrolidino]propyl]butyramide](/api/spectrum/64bFSZR5DBJ/structure.png?h=300&w=458 "N-[3-[2-[2-(2-hydroxy-6-methyl-phenyl)-2-keto-ethyl]pyrrolidino]propyl]butyramide")
| SpectraBase Compound ID | KQpHKskEnwF |
|---|---|
| InChI | InChI=1S/C20H30N2O3/c1-3-7-19(25)21-11-6-13-22-12-5-9-16(22)14-18(24)20-15(2)8-4-10-17(20)23/h4,8,10,16,23H,3,5-7,9,11-14H2,1-2H3,(H,21,25) |
| InChIKey | UHGWRNKEZUWTHK-UHFFFAOYSA-N |
| Mol Weight | 346.47 g/mol |
| Molecular Formula | C20H30N2O3 |
| Exact Mass | 346.225643 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 64bFSZR5DBJ |
|---|---|
| Name | N-[3-[2-[2-(2-Hydroxy-6-methyl-phenyl)-2-keto-ethyl]pyrrolidino]propyl]butyramide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 346.225642831 u |
| Formula | C20H30N2O3 |
| InChI | InChI=1S/C20H30N2O3/c1-3-7-19(25)21-11-6-13-22-12-5-9-16(22)14-18(24)20-15(2)8-4-10-17(20)23/h4,8,10,16,23H,3,5-7,9,11-14H2,1-2H3,(H,21,25) |
| InChIKey | UHGWRNKEZUWTHK-UHFFFAOYSA-N |
| Molecular Weight | 346.471 g/mol |
| SMILES | C(C=1C(O)=CC=CC1C)(CC1N(CCCNC(=O)CCC)CCC1)=O |