| SpectraBase Compound ID | 4FbyJNfxpVi |
|---|---|
| InChI | InChI=1S/C10H8INO2/c1-2-14-10(13)8-5-7(6-12)3-4-9(8)11/h3-5H,2H2,1H3 |
| InChIKey | NVXMAWYOEQFNQK-UHFFFAOYSA-N |
| Mol Weight | 301.08 g/mol |
| Molecular Formula | C10H8INO2 |
| Exact Mass | 300.959973 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | EcfxNdnpQ6h |
|---|---|
| Name | Ethyl 5-cyano-2-iodobenzoate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C10H8INO2 |
| InChI | InChI=1S/C10H8INO2/c1-2-14-10(13)8-5-7(6-12)3-4-9(8)11/h3-5H,2H2,1H3 |
| InChIKey | NVXMAWYOEQFNQK-UHFFFAOYSA-N |
| Literature Reference DOI | 10.1002/anie.201403688 |
| Molecular Weight | 301.083 g/mol |
| SMILES | c1c(C#N)ccc(I)c1C(=O)OCC |
| SPLASH | splash10-0zor-0394000000-ffabe558852798d58967 |
| Source of Spectrum | ACI-53-SM13-4e |
| Wiley ID | 1782647 |