| SpectraBase Compound ID | HK28ecoObb2 |
|---|---|
| InChI | InChI=1S/C16H11NO4/c1-20-16(19)13-4-2-3-5-14(13)21-15(18)12-8-6-11(10-17)7-9-12/h2-9H,1H3 |
| InChIKey | YTYAEDGQRCWROS-UHFFFAOYSA-N |
| Mol Weight | 281.27 g/mol |
| Molecular Formula | C16H11NO4 |
| Exact Mass | 281.068808 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | B1fOAIzp2Le |
|---|---|
| Name | O-(4-Cyanobenzoyl)salicyclic acid methyl ester |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C16H11NO4 |
| InChI | InChI=1S/C16H11NO4/c1-20-16(19)13-4-2-3-5-14(13)21-15(18)12-8-6-11(10-17)7-9-12/h2-9H,1H3 |
| InChIKey | YTYAEDGQRCWROS-UHFFFAOYSA-N |
| Molecular Weight | 281.267 g/mol |
| SMILES | c1(c(OC(c2ccc(C#N)cc2)=O)cccc1)C(=O)OC |
| SPLASH | splash10-000i-0910000000-30c3ef2aef9c4ab76563 |
| Source of Spectrum | J-65-3452-2 |
| Wiley ID | 1532297 |