| SpectraBase Compound ID | GOKjOCJQo2p |
|---|---|
| InChI | InChI=1S/C15H18N2O4/c1-2-3-10-21-13(18)8-9-17-15(20)12-7-5-4-6-11(12)14(19)16-17/h4-7H,2-3,8-10H2,1H3,(H,16,19) |
| InChIKey | LKQQLTUSZYWCIR-UHFFFAOYSA-N |
| Mol Weight | 290.32 g/mol |
| Molecular Formula | C15H18N2O4 |
| Exact Mass | 290.126657 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GjFZKdNE11B |
|---|---|
| Name | Butyl 3-(1,4-dioxo-3,4-dihydro-2(1H)-phthalazinyl)propanoate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 290.126657064 u |
| Formula | C15H18N2O4 |
| InChI | InChI=1S/C15H18N2O4/c1-2-3-10-21-13(18)8-9-17-15(20)12-7-5-4-6-11(12)14(19)16-17/h4-7H,2-3,8-10H2,1H3,(H,16,19) |
| InChIKey | LKQQLTUSZYWCIR-UHFFFAOYSA-N |
| Molecular Weight | 290.319 g/mol |
| SMILES | N1C(C=2C=CC=CC2C(N1CCC(=O)OCCCC)=O)=O |