| SpectraBase Compound ID | KDSaa0YRPFK |
|---|---|
| InChI | InChI=1S/C9H8ClNO4/c10-6-3-5(4-11-9(6)15)7(12)1-2-8(13)14/h3-4H,1-2H2,(H,11,15)(H,13,14) |
| InChIKey | MJTIZFUTSGUUER-UHFFFAOYSA-N |
| Mol Weight | 229.62 g/mol |
| Molecular Formula | C9H8ClNO4 |
| Exact Mass | 229.014185 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9cc6m3IW9bU |
|---|---|
| Name | 4-(5-CHLORO-1,6-DIHYDRO-6-OXO-PYRIDIN-3-YL)-4-OXOBUTYRIC-ACID |
| Compound Number | 8 |
| Copyright | Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| InChI | InChI=1S/C9H8ClNO4/c10-6-3-5(4-11-9(6)15)7(12)1-2-8(13)14/h3-4H,1-2H2,(H,11,15)(H,13,14) |
| InChIKey | MJTIZFUTSGUUER-UHFFFAOYSA-N |
| Literature Reference | J.P.RODUIT,A.WELLIG,A.KIENER HETEROCYCLES,45,1687(1997) |
| Solvent | Dimethyl sulfoxide-d6 |