| SpectraBase Compound ID | ABpviOqTpY |
|---|---|
| InChI | InChI=1S/C12H22O3/c1-5-6-7-8-10(13)9-11(14)15-12(2,3)4/h5-9H2,1-4H3 |
| InChIKey | TVJTYAVGPKFLSO-UHFFFAOYSA-N |
| Mol Weight | 214.3 g/mol |
| Molecular Formula | C12H22O3 |
| Exact Mass | 214.156895 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 7IFUQ9QtiD5 |
|---|---|
| Name | 3-oxooctanoic acid t-butyl ester |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C12H22O3 |
| InChI | InChI=1S/C12H22O3/c1-5-6-7-8-10(13)9-11(14)15-12(2,3)4/h5-9H2,1-4H3 |
| InChIKey | TVJTYAVGPKFLSO-UHFFFAOYSA-N |
| Ionization Type | EI |
| Molecular Weight | 214.305 g/mol |
| Reported Formula | C12H22O3 |
| SMILES | C(=O)(CC(=O)OC(C)(C)C)CCCCC |
| SPLASH | splash10-0a4i-1900000000-89131c4a07109659b973 |
| Source of Spectrum | US20100249057A1 |
| Wiley ID | 1844092 |