| SpectraBase Compound ID | 7WBbX876QJX |
|---|---|
| InChI | InChI=1S/C18H19NO3/c1-2-12-22-18(21)14-10-11-19-15(14)8-9-16(19)17(20)13-6-4-3-5-7-13/h3-9,14H,2,10-12H2,1H3 |
| InChIKey | RFJBUHZBMZQPHX-UHFFFAOYSA-N |
| Mol Weight | 297.35 g/mol |
| Molecular Formula | C18H19NO3 |
| Exact Mass | 297.136493 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CNk3lwGusHC |
|---|---|
| Name | Ketorolac, propyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 297.136493473 u |
| Formula | C18H19NO3 |
| InChI | InChI=1S/C18H19NO3/c1-2-12-22-18(21)14-10-11-19-15(14)8-9-16(19)17(20)13-6-4-3-5-7-13/h3-9,14H,2,10-12H2,1H3 |
| InChIKey | RFJBUHZBMZQPHX-UHFFFAOYSA-N |
| Molecular Weight | 297.354 g/mol |
| SMILES | C1(=CC=CC=C1)C(C1=CC=C2N1CCC2C(OCCC)=O)=O |