| SpectraBase Compound ID | 82YX1FeP3fm |
|---|---|
| InChI | InChI=1S/C6H12O2/c1-5(2)4-6(7)8-3/h5H,4H2,1-3H3 |
| InChIKey | OQAGVSWESNCJJT-UHFFFAOYSA-N |
| Mol Weight | 116.16 g/mol |
| Molecular Formula | C6H12O2 |
| Exact Mass | 116.08373 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | Ykc8LLMtLs |
|---|---|
| Name | Methyl isovalerate |
| Alternate Name(s) | 3-Methylbutanoic acid methyl ester |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C6H12O2 |
| InChI | InChI=1S/C6H12O2/c1-5(2)4-6(7)8-3/h5H,4H2,1-3H3 |
| InChIKey | OQAGVSWESNCJJT-UHFFFAOYSA-N |
| Ionization Type | EI-B |
| Molecular Weight | 116.160 g/mol |
| SMILES | COC(=O)CC(C)C |
| SPLASH | splash10-00dl-9000000000-e7443ea8207a9c448de3 |
| Source of Spectrum | SRH-2022-5298-0 |
| Wiley ID | 1827370 |