![1-Ethyl-7-methyl-4-oxo-1,4-dihydro[1,8]naphthyridine-3-carboxylic acid, methyl ester](/api/spectrum/9vSXizzbKR4/structure.png?h=300&w=458 "1-Ethyl-7-methyl-4-oxo-1,4-dihydro[1,8]naphthyridine-3-carboxylic acid, methyl ester")
| SpectraBase Compound ID | BhdT644G00W |
|---|---|
| InChI | InChI=1S/C13H14N2O3/c1-4-15-7-10(13(17)18-3)11(16)9-6-5-8(2)14-12(9)15/h5-7H,4H2,1-3H3 |
| InChIKey | HAXZNPSPJMKMIQ-UHFFFAOYSA-N |
| Mol Weight | 246.27 g/mol |
| Molecular Formula | C13H14N2O3 |
| Exact Mass | 246.100442 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9vSXizzbKR4 |
|---|---|
| Name | 1-Ethyl-7-methyl-4-oxo-1,4-dihydro[1,8]naphthyridine-3-carboxylic acid, methyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 246.100442316 u |
| Formula | C13H14N2O3 |
| InChI | InChI=1S/C13H14N2O3/c1-4-15-7-10(13(17)18-3)11(16)9-6-5-8(2)14-12(9)15/h5-7H,4H2,1-3H3 |
| InChIKey | HAXZNPSPJMKMIQ-UHFFFAOYSA-N |
| Molecular Weight | 246.266 g/mol |
| SMILES | CCN1C2=C(C(C(=C1)C(OC)=O)=O)C=CC(C)=N2 |