| SpectraBase Compound ID | GoClCcChFnG |
|---|---|
| InChI | InChI=1S/C12H11NO3/c1-2-16-12(15)10-6-4-3-5-9(10)11(14)7-8-13/h3-6H,2,7H2,1H3 |
| InChIKey | SGDODUDFAIJOJD-UHFFFAOYSA-N |
| Mol Weight | 217.22 g/mol |
| Molecular Formula | C12H11NO3 |
| Exact Mass | 217.073893 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 9dIvWCSRxbe |
|---|---|
| Name | Ethyl 2-cyanoacetylbenzoate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C12H11NO3 |
| InChI | InChI=1S/C12H11NO3/c1-2-16-12(15)10-6-4-3-5-9(10)11(14)7-8-13/h3-6H,2,7H2,1H3 |
| InChIKey | SGDODUDFAIJOJD-UHFFFAOYSA-N |
| Molecular Weight | 217.224 g/mol |
| SMILES | c1(c(C(=O)CC#N)cccc1)C(=O)OCC |
| SPLASH | splash10-0002-0900000000-209c2a8f48d34b01b55c |
| Source of Spectrum | F-53-6111-29 |
| Wiley ID | 801945 |