| SpectraBase Compound ID | 5ThozAdS75B |
|---|---|
| InChI | InChI=1S/C12H13NO3/c1-4-16-12(15)11-8(3)9(6-13)7(2)5-10(11)14/h5,14H,4H2,1-3H3 |
| InChIKey | BOINVZYCQFXZMA-UHFFFAOYSA-N |
| Mol Weight | 219.24 g/mol |
| Molecular Formula | C12H13NO3 |
| Exact Mass | 219.089543 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | GHKalqTXzlM |
|---|---|
| Name | Ethyl 3-Cyano-6-hydroxy-2,4-dimethylbenzoate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C12H13NO3 |
| InChI | InChI=1S/C12H13NO3/c1-4-16-12(15)11-8(3)9(6-13)7(2)5-10(11)14/h5,14H,4H2,1-3H3 |
| InChIKey | BOINVZYCQFXZMA-UHFFFAOYSA-N |
| Molecular Weight | 219.240 g/mol |
| SMILES | Oc1c(c(c(C#N)c(c1)C)C)C(=O)OCC |
| SPLASH | splash10-00di-0920000000-0b65d5f36bb62eab40cc |
| Source of Spectrum | F4-41-1633-6b |
| Wiley ID | 1672317 |