| SpectraBase Compound ID | 8AtNcQc1I8U |
|---|---|
| InChI | InChI=1S/C11H8N2O2/c1-8(6-12)15-11(14)10-4-2-9(7-13)3-5-10/h2-5,8H,1H3 |
| InChIKey | VWBPAXHZCUQDAE-UHFFFAOYSA-N |
| Mol Weight | 200.2 g/mol |
| Molecular Formula | C11H8N2O2 |
| Exact Mass | 200.058578 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 2CoP6vOx6ul |
|---|---|
| Name | 1-cyanoethyl 4-cyanobenzoate |
| Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C11H8N2O2 |
| InChI | InChI=1S/C11H8N2O2/c1-8(6-12)15-11(14)10-4-2-9(7-13)3-5-10/h2-5,8H,1H3 |
| InChIKey | VWBPAXHZCUQDAE-UHFFFAOYSA-N |
| Molecular Weight | 200.197 g/mol |
| SMILES | C(OC(C#N)C)(c1ccc(C#N)cc1)=O |
| SPLASH | splash10-0f89-1900000000-f32987676dc1d6864478 |
| Source of Spectrum | AJ-63-1809-18 |
| Synonyms | 4-cyanobenzoic acid 1-cyanoethyl ester |
| Wiley ID | 1197622 |