| SpectraBase Compound ID | 72Xax7d8BEA |
|---|---|
| InChI | InChI=1S/C10H9NO2/c1-2-13-10(12)9-5-3-4-8(6-9)7-11/h3-6H,2H2,1H3 |
| InChIKey | ZKXMKMLGUYSGNS-UHFFFAOYSA-N |
| Mol Weight | 175.19 g/mol |
| Molecular Formula | C10H9NO2 |
| Exact Mass | 175.063329 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 3gcafK4f1ZS |
|---|---|
| Name | Ethyl 3-cyanobenzoate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C10H9NO2 |
| InChI | InChI=1S/C10H9NO2/c1-2-13-10(12)9-5-3-4-8(6-9)7-11/h3-6H,2H2,1H3 |
| InChIKey | ZKXMKMLGUYSGNS-UHFFFAOYSA-N |
| Literature Reference DOI | 10.1002/anie.201403688 |
| Molecular Weight | 175.187 g/mol |
| SMILES | c1ccc(cc1C(OCC)=O)C#N |
| SPLASH | splash10-001i-0900000000-6c93c5d10e50d0d33301 |
| Source of Spectrum | ACI-53-SM8-1b |
| Wiley ID | 1782643 |