| SpectraBase Compound ID | LkFiHRCqroo |
|---|---|
| InChI | InChI=1S/C14H17NO3/c1-4-5-6-10-7-11(8-15)9(2)12(13(10)16)14(17)18-3/h7,16H,4-6H2,1-3H3 |
| InChIKey | POABQCCKRHBKNI-UHFFFAOYSA-N |
| Mol Weight | 247.29 g/mol |
| Molecular Formula | C14H17NO3 |
| Exact Mass | 247.120843 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | DYw4JFgJu9w |
|---|---|
| Name | Methyl 3-Butyl-5-cyano-2-hydroxy-6-methylbenzoate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C14H17NO3 |
| InChI | InChI=1S/C14H17NO3/c1-4-5-6-10-7-11(8-15)9(2)12(13(10)16)14(17)18-3/h7,16H,4-6H2,1-3H3 |
| InChIKey | POABQCCKRHBKNI-UHFFFAOYSA-N |
| Molecular Weight | 247.294 g/mol |
| SMILES | Oc1c(c(c(C#N)cc1CCCC)C)C(=O)OC |
| SPLASH | splash10-00dj-1930000000-9071e4ab31245bcac621 |
| Source of Spectrum | F4-41-1627-4e |
| Wiley ID | 1672340 |