| SpectraBase Compound ID | KKzAiIxQ8wY |
|---|---|
| InChI | InChI=1S/C11H12N2O4/c1-3-16-9-7(5-12)6-13-10(14)8(9)11(15)17-4-2/h6H,3-4H2,1-2H3,(H,13,14) |
| InChIKey | NMTDVLDYQNPEIF-UHFFFAOYSA-N |
| Mol Weight | 236.23 g/mol |
| Molecular Formula | C11H12N2O4 |
| Exact Mass | 236.079707 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 5qSqe59NFuV |
|---|---|
| Name | Ethyl 5-cyano-4-ethoxy-2-hydroxynicotinate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C11H12N2O4 |
| InChI | InChI=1S/C11H12N2O4/c1-3-16-9-7(5-12)6-13-10(14)8(9)11(15)17-4-2/h6H,3-4H2,1-2H3,(H,13,14) |
| InChIKey | NMTDVLDYQNPEIF-UHFFFAOYSA-N |
| Molecular Weight | 236.227 g/mol |
| SMILES | Oc1c(C(OCC)=O)c(c(cn1)C#N)OCC |
| SPLASH | splash10-03fr-5910000000-fa0edddff56498ae83f7 |
| Source of Spectrum | JX-2015-1-59 |
| Wiley ID | 1720923 |