| SpectraBase Compound ID | C2EgNyKnLAx |
|---|---|
| InChI | InChI=1S/C13H17NO4/c15-12-3-1-11(2-4-12)13(16)18-10-7-14-5-8-17-9-6-14/h1-4,15H,5-10H2 |
| InChIKey | AJSLXVBGYKJOJG-UHFFFAOYSA-N |
| Mol Weight | 251.28 g/mol |
| Molecular Formula | C13H17NO4 |
| Exact Mass | 251.115758 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7nrffVXHFU5 |
|---|---|
| Name | Benzoic acid, 4-hydroxy-, 2-(4-morpholinyl)ethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 251.115758027 u |
| Formula | C13H17NO4 |
| InChI | InChI=1S/C13H17NO4/c15-12-3-1-11(2-4-12)13(16)18-10-7-14-5-8-17-9-6-14/h1-4,15H,5-10H2 |
| InChIKey | AJSLXVBGYKJOJG-UHFFFAOYSA-N |
| Molecular Weight | 251.282 g/mol |
| SMILES | OC1=CC=C(C(=O)OCCN2CCOCC2)C=C1 |