![Benzoic acid, 4-[1-oxo-2-(1-pyrrolidinyl)ethyl]amino-, methyl ester](/api/spectrum/CgWBWvsV3Tj/structure.png?h=300&w=458 "Benzoic acid, 4-[1-oxo-2-(1-pyrrolidinyl)ethyl]amino-, methyl ester")
| SpectraBase Compound ID | 2W4spquWOzj |
|---|---|
| InChI | InChI=1S/C14H18N2O3/c1-19-14(18)11-4-6-12(7-5-11)15-13(17)10-16-8-2-3-9-16/h4-7H,2-3,8-10H2,1H3,(H,15,17) |
| InChIKey | KTWAAVQGZWBOHQ-UHFFFAOYSA-N |
| Mol Weight | 262.31 g/mol |
| Molecular Formula | C14H18N2O3 |
| Exact Mass | 262.131742 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CgWBWvsV3Tj |
|---|---|
| Name | Benzoic acid, 4-[1-oxo-2-(1-pyrrolidinyl)ethyl]amino-, methyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 262.131742445 u |
| Formula | C14H18N2O3 |
| InChI | InChI=1S/C14H18N2O3/c1-19-14(18)11-4-6-12(7-5-11)15-13(17)10-16-8-2-3-9-16/h4-7H,2-3,8-10H2,1H3,(H,15,17) |
| InChIKey | KTWAAVQGZWBOHQ-UHFFFAOYSA-N |
| Molecular Weight | 262.309 g/mol |
| SMILES | C(NC=1C=CC(C(=O)OC)=CC1)(CN1CCCC1)=O |