![Propanoic acid, 3-[5-(3-methoxy-3-oxopropyl)-2-pyrazinyl]-, methyl ester](/api/spectrum/1qS7FROz3bf/structure.png?h=300&w=458 "Propanoic acid, 3-[5-(3-methoxy-3-oxopropyl)-2-pyrazinyl]-, methyl ester")
| SpectraBase Compound ID | CYkTA5WU5KU |
|---|---|
| InChI | InChI=1S/C12H16N2O4/c1-17-11(15)5-3-9-7-14-10(8-13-9)4-6-12(16)18-2/h7-8H,3-6H2,1-2H3 |
| InChIKey | CAVDNRICPLKYEH-UHFFFAOYSA-N |
| Mol Weight | 252.27 g/mol |
| Molecular Formula | C12H16N2O4 |
| Exact Mass | 252.111007 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 1qS7FROz3bf |
|---|---|
| Name | |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C12H16N2O4 |
| InChI | InChI=1S/C12H16N2O4/c1-17-11(15)5-3-9-7-14-10(8-13-9)4-6-12(16)18-2/h7-8H,3-6H2,1-2H3 |
| InChIKey | CAVDNRICPLKYEH-UHFFFAOYSA-N |
| Molecular Weight | 252.1106 |
| SMILES | c1(CCC(OC)=O)cnc(CCC(=O)OC)cn1 |
| SPLASH | splash10-0006-2930000000-c53663d94076ef1a83e7 |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |