| SpectraBase Compound ID | JablnyB0Uz2 |
|---|---|
| InChI | InChI=1S/C13H16N2O3/c1-7-8(2)11(16)15-10(7)9(6-14)12(17)18-13(3,4)5/h1-5H3,(H,15,16)/b10-9+ |
| InChIKey | HEOKXUSLALVFKM-MDZDMXLPSA-N |
| Mol Weight | 248.28 g/mol |
| Molecular Formula | C13H16N2O3 |
| Exact Mass | 248.116092 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | A6dMXY8Gp2S |
|---|---|
| Name | |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C13H16N2O3 |
| InChI | InChI=1S/C13H16N2O3/c1-7-8(2)11(16)15-10(7)9(6-14)12(17)18-13(3,4)5/h1-5H3,(H,15,16)/b10-9+ |
| InChIKey | HEOKXUSLALVFKM-MDZDMXLPSA-N |
| Molecular Weight | 248.1157 |
| SMILES | N1C(C(=C(\C1=C/(C#N)C(=O)OC(C)(C)C)C)C)=O |
| SPLASH | splash10-0a4m-9700000000-83ff59d06c75d00c1f28 |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |