| SpectraBase Compound ID | B0Oq5D1guEz |
|---|---|
| InChI | InChI=1S/C9H16O4/c1-4-13-9(12)7(6(2)3)5-8(10)11/h6-7H,4-5H2,1-3H3,(H,10,11) |
| InChIKey | CZVLJKQZXSGJNW-UHFFFAOYSA-N |
| Mol Weight | 188.22 g/mol |
| Molecular Formula | C9H16O4 |
| Exact Mass | 188.104859 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 39lJmtnzKC |
|---|---|
| Name | 3-carbethoxy-4-methyl-valeric acid |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C9H16O4 |
| InChI | InChI=1S/C9H16O4/c1-4-13-9(12)7(6(2)3)5-8(10)11/h6-7H,4-5H2,1-3H3,(H,10,11) |
| InChIKey | CZVLJKQZXSGJNW-UHFFFAOYSA-N |
| Molecular Weight | 188.223 g/mol |
| SMILES | OC(CC(C(=O)OCC)C(C)C)=O |
| SPLASH | splash10-052f-9500000000-83724836d9c9bb20cca6 |
| Source of Spectrum | AN-103-440-17 |
| Synonyms | 3-Ethoxycarbonyl-4-methylpentanoic acid |
| Wiley ID | 747474 |