| SpectraBase Compound ID | LhQELaHZecP |
|---|---|
| InChI | InChI=1S/C7H12O2/c1-4-5-9-7(8)6(2)3/h4,6H,1,5H2,2-3H3 |
| InChIKey | QNBDJTKBKITRJI-UHFFFAOYSA-N |
| Mol Weight | 128.17 g/mol |
| Molecular Formula | C7H12O2 |
| Exact Mass | 128.08373 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 85ExdoAgyQF |
|---|---|
| Name | Allyl isobutyrate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C7H12O2 |
| InChI | InChI=1S/C7H12O2/c1-4-5-9-7(8)6(2)3/h4,6H,1,5H2,2-3H3 |
| InChIKey | QNBDJTKBKITRJI-UHFFFAOYSA-N |
| Ionization Type | EI-B |
| Molecular Weight | 128.171 g/mol |
| SMILES | C=CCOC(=O)C(C)C |
| SPLASH | splash10-0006-9000000000-5aba6975562cf61c90ba |
| Source of Spectrum | SRH-2022-6965-0 |
| Wiley ID | 1828766 |