| SpectraBase Compound ID | LlOx89gBAVJ |
|---|---|
| InChI | InChI=1S/C17H17NO3/c1-2-21-17(20)13-10-11-18-14(13)8-9-15(18)16(19)12-6-4-3-5-7-12/h3-9,13H,2,10-11H2,1H3 |
| InChIKey | ZXHMVDVCMQIUCB-UHFFFAOYSA-N |
| Mol Weight | 283.33 g/mol |
| Molecular Formula | C17H17NO3 |
| Exact Mass | 283.120843 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | L9IHKOxmIE0 |
|---|---|
| Name | Ketorolac ethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 283.120843408 u |
| Formula | C17H17NO3 |
| InChI | InChI=1S/C17H17NO3/c1-2-21-17(20)13-10-11-18-14(13)8-9-15(18)16(19)12-6-4-3-5-7-12/h3-9,13H,2,10-11H2,1H3 |
| InChIKey | ZXHMVDVCMQIUCB-UHFFFAOYSA-N |
| SMILES | C1CC(C(=O)OCC)C=2N1C(C(C1=CC=CC=C1)=O)=CC2 |