| SpectraBase Compound ID | 23yeUkPBUqi |
|---|---|
| InChI | InChI=1S/C13H15NO3/c1-5-9-7(2)10(6-14)8(3)11(12(9)15)13(16)17-4/h15H,5H2,1-4H3 |
| InChIKey | FPBOMIYQQREMOC-UHFFFAOYSA-N |
| Mol Weight | 233.27 g/mol |
| Molecular Formula | C13H15NO3 |
| Exact Mass | 233.105193 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | DAJ9FOsvSHh |
|---|---|
| Name | Methyl 3-Cyano-5-ethyl-6-hydroxy-2,4-dimethylbenzoate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C13H15NO3 |
| InChI | InChI=1S/C13H15NO3/c1-5-9-7(2)10(6-14)8(3)11(12(9)15)13(16)17-4/h15H,5H2,1-4H3 |
| InChIKey | FPBOMIYQQREMOC-UHFFFAOYSA-N |
| Molecular Weight | 233.267 g/mol |
| SMILES | Oc1c(c(c(c(C)c1CC)C#N)C)C(=O)OC |
| SPLASH | splash10-0ul0-0890000000-431f04fad872f14f24e3 |
| Source of Spectrum | F4-41-1633-6e |
| Wiley ID | 1672314 |